smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)CC1CC[NH+](C)CC1 ZINC000063120738 184271860 /nfs/dbraw/zinc/27/18/60/184271860.db2.gz BQEOFSBMCHFJEB-UHFFFAOYSA-N 2 1 311.813 3.022 10 5 DGBEMP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000247962769 432257024 /nfs/dbraw/zinc/25/70/24/432257024.db2.gz GKGWBQGWMJORQE-UNEWFSDZSA-N 2 1 303.406 3.072 10 5 DGBEMP C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000247962769 432257029 /nfs/dbraw/zinc/25/70/29/432257029.db2.gz GKGWBQGWMJORQE-UNEWFSDZSA-N 2 1 303.406 3.072 10 5 DGBEMP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000247962769 432257031 /nfs/dbraw/zinc/25/70/31/432257031.db2.gz GKGWBQGWMJORQE-UNEWFSDZSA-N 2 1 303.406 3.072 10 5 DGBEMP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000247962769 432257035 /nfs/dbraw/zinc/25/70/35/432257035.db2.gz GKGWBQGWMJORQE-UNEWFSDZSA-N 2 1 303.406 3.072 10 5 DGBEMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000127286315 284333259 /nfs/dbraw/zinc/33/32/59/284333259.db2.gz LGYDJMMZENMQHC-CYBMUJFWSA-N 2 1 302.378 3.183 10 5 DGBEMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000127286315 284333263 /nfs/dbraw/zinc/33/32/63/284333263.db2.gz LGYDJMMZENMQHC-CYBMUJFWSA-N 2 1 302.378 3.183 10 5 DGBEMP CCC[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CC[NH2+]CC1 ZINC000157882413 521683417 /nfs/dbraw/zinc/68/34/17/521683417.db2.gz PGKPKXSOUKFXGH-UHFFFAOYSA-N 2 1 311.813 3.212 10 5 DGBEMP CCC[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CC[NH2+]CC1 ZINC000157882413 521683420 /nfs/dbraw/zinc/68/34/20/521683420.db2.gz PGKPKXSOUKFXGH-UHFFFAOYSA-N 2 1 311.813 3.212 10 5 DGBEMP CC[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@H]1CCC[NH2+]CC1 ZINC000261979765 655656674 /nfs/dbraw/zinc/65/66/74/655656674.db2.gz RFUCGNXXWNOPGV-ZDUSSCGKSA-N 2 1 311.813 3.212 10 5 DGBEMP CC[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@H]1CCC[NH2+]CC1 ZINC000261979765 655656676 /nfs/dbraw/zinc/65/66/76/655656676.db2.gz RFUCGNXXWNOPGV-ZDUSSCGKSA-N 2 1 311.813 3.212 10 5 DGBEMP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000247962766 432256284 /nfs/dbraw/zinc/25/62/84/432256284.db2.gz GKGWBQGWMJORQE-UKPHBRMFSA-N 2 1 303.406 3.072 10 5 DGBEMP C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000247962766 432256286 /nfs/dbraw/zinc/25/62/86/432256286.db2.gz GKGWBQGWMJORQE-UKPHBRMFSA-N 2 1 303.406 3.072 10 5 DGBEMP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000247962766 432256288 /nfs/dbraw/zinc/25/62/88/432256288.db2.gz GKGWBQGWMJORQE-UKPHBRMFSA-N 2 1 303.406 3.072 10 5 DGBEMP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000247962766 432256292 /nfs/dbraw/zinc/25/62/92/432256292.db2.gz GKGWBQGWMJORQE-UKPHBRMFSA-N 2 1 303.406 3.072 10 5 DGBEMP CC[NH2+]CC1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000157908317 519914777 /nfs/dbraw/zinc/91/47/77/519914777.db2.gz SJGOQAKXOQMMRK-UHFFFAOYSA-N 2 1 311.813 3.070 10 5 DGBEMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000093638944 193278774 /nfs/dbraw/zinc/27/87/74/193278774.db2.gz IPYSIQWIIJLGJM-ZBFHGGJFSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000093638944 193278775 /nfs/dbraw/zinc/27/87/75/193278775.db2.gz IPYSIQWIIJLGJM-ZBFHGGJFSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000093638944 193278776 /nfs/dbraw/zinc/27/87/76/193278776.db2.gz IPYSIQWIIJLGJM-ZBFHGGJFSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000093638944 193278777 /nfs/dbraw/zinc/27/87/77/193278777.db2.gz IPYSIQWIIJLGJM-ZBFHGGJFSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000183363576 432286009 /nfs/dbraw/zinc/28/60/09/432286009.db2.gz PALBVRRYWHVXEW-RHSMWYFYSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000183363576 432286013 /nfs/dbraw/zinc/28/60/13/432286013.db2.gz PALBVRRYWHVXEW-RHSMWYFYSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000183363576 432286016 /nfs/dbraw/zinc/28/60/16/432286016.db2.gz PALBVRRYWHVXEW-RHSMWYFYSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000183363576 432286020 /nfs/dbraw/zinc/28/60/20/432286020.db2.gz PALBVRRYWHVXEW-RHSMWYFYSA-N 2 1 305.422 3.065 10 5 DGBEMP Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000183360875 432287213 /nfs/dbraw/zinc/28/72/13/432287213.db2.gz QOSFZJRJQWVYBS-KRWDZBQOSA-N 2 1 317.433 3.354 10 5 DGBEMP Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000183360875 432287217 /nfs/dbraw/zinc/28/72/17/432287217.db2.gz QOSFZJRJQWVYBS-KRWDZBQOSA-N 2 1 317.433 3.354 10 5 DGBEMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000245422011 432829264 /nfs/dbraw/zinc/82/92/64/432829264.db2.gz IIJPSWOQHYXWQY-BBRMVZONSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000245422011 432829266 /nfs/dbraw/zinc/82/92/66/432829266.db2.gz IIJPSWOQHYXWQY-BBRMVZONSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000245422011 432829268 /nfs/dbraw/zinc/82/92/68/432829268.db2.gz IIJPSWOQHYXWQY-BBRMVZONSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000245422011 432829270 /nfs/dbraw/zinc/82/92/70/432829270.db2.gz IIJPSWOQHYXWQY-BBRMVZONSA-N 2 1 305.422 3.065 10 5 DGBEMP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000158575092 197284658 /nfs/dbraw/zinc/28/46/58/197284658.db2.gz GKGWBQGWMJORQE-FRFSOERESA-N 2 1 303.406 3.072 10 5 DGBEMP C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000158575092 197284660 /nfs/dbraw/zinc/28/46/60/197284660.db2.gz GKGWBQGWMJORQE-FRFSOERESA-N 2 1 303.406 3.072 10 5 DGBEMP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000158575092 197284662 /nfs/dbraw/zinc/28/46/62/197284662.db2.gz GKGWBQGWMJORQE-FRFSOERESA-N 2 1 303.406 3.072 10 5 DGBEMP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000158575092 197284663 /nfs/dbraw/zinc/28/46/63/197284663.db2.gz GKGWBQGWMJORQE-FRFSOERESA-N 2 1 303.406 3.072 10 5 DGBEMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000127286045 284333371 /nfs/dbraw/zinc/33/33/71/284333371.db2.gz LGYDJMMZENMQHC-ZDUSSCGKSA-N 2 1 302.378 3.183 10 5 DGBEMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000127286045 284333375 /nfs/dbraw/zinc/33/33/75/284333375.db2.gz LGYDJMMZENMQHC-ZDUSSCGKSA-N 2 1 302.378 3.183 10 5 DGBEMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+](C)[C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000470181810 533407878 /nfs/dbraw/zinc/40/78/78/533407878.db2.gz HDHZTLGEYDYRCA-SOOMZGJCSA-N 2 1 317.433 3.413 10 5 DGBEMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+](C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000470181810 533407880 /nfs/dbraw/zinc/40/78/80/533407880.db2.gz HDHZTLGEYDYRCA-SOOMZGJCSA-N 2 1 317.433 3.413 10 5 DGBEMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@@H]1CC[NH+](C)[C@H](C)C1 ZINC000470181810 533407883 /nfs/dbraw/zinc/40/78/83/533407883.db2.gz HDHZTLGEYDYRCA-SOOMZGJCSA-N 2 1 317.433 3.413 10 5 DGBEMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@@H]1CC[NH+](C)[C@H](C)C1 ZINC000470181810 533407888 /nfs/dbraw/zinc/40/78/88/533407888.db2.gz HDHZTLGEYDYRCA-SOOMZGJCSA-N 2 1 317.433 3.413 10 5 DGBEMP O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2Cn2ccnc2)c(Cl)c1 ZINC000185224079 432479632 /nfs/dbraw/zinc/47/96/32/432479632.db2.gz JZCYBORSZCLQKZ-AWEZNQCLSA-N 2 1 320.780 3.109 10 5 DGBEMP O=[N+]([O-])c1ccc(CN2CCC[C@H]2Cn2ccnc2)c(Cl)c1 ZINC000185224079 432479639 /nfs/dbraw/zinc/47/96/39/432479639.db2.gz JZCYBORSZCLQKZ-AWEZNQCLSA-N 2 1 320.780 3.109 10 5 DGBEMP CCC[NH+]1CCC([N@H+](C)Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000183292889 432280194 /nfs/dbraw/zinc/28/01/94/432280194.db2.gz BNDMZMWJVGLBPD-UHFFFAOYSA-N 2 1 305.422 3.209 10 5 DGBEMP CCC[NH+]1CCC([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000183292889 432280196 /nfs/dbraw/zinc/28/01/96/432280196.db2.gz BNDMZMWJVGLBPD-UHFFFAOYSA-N 2 1 305.422 3.209 10 5 DGBEMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000248630575 432308330 /nfs/dbraw/zinc/30/83/30/432308330.db2.gz PALBVRRYWHVXEW-WMLDXEAASA-N 2 1 305.422 3.065 10 5 DGBEMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000248630575 432308334 /nfs/dbraw/zinc/30/83/34/432308334.db2.gz PALBVRRYWHVXEW-WMLDXEAASA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000248630575 432308337 /nfs/dbraw/zinc/30/83/37/432308337.db2.gz PALBVRRYWHVXEW-WMLDXEAASA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000248630575 432308340 /nfs/dbraw/zinc/30/83/40/432308340.db2.gz PALBVRRYWHVXEW-WMLDXEAASA-N 2 1 305.422 3.065 10 5 DGBEMP CC[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@@H]1CCC[NH2+]CC1 ZINC000261979763 657270966 /nfs/dbraw/zinc/27/09/66/657270966.db2.gz RFUCGNXXWNOPGV-CYBMUJFWSA-N 2 1 311.813 3.212 10 5 DGBEMP CC[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@@H]1CCC[NH2+]CC1 ZINC000261979763 657270970 /nfs/dbraw/zinc/27/09/70/657270970.db2.gz RFUCGNXXWNOPGV-CYBMUJFWSA-N 2 1 311.813 3.212 10 5 DGBEMP CC[N@@H+]1CC[C@H]([NH+](C)C/C=C/c2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000093638785 284013765 /nfs/dbraw/zinc/01/37/65/284013765.db2.gz VJRRTZZSAQIOLF-FUZMGVLZSA-N 2 1 317.433 3.270 10 5 DGBEMP CC[N@H+]1CC[C@H]([NH+](C)C/C=C/c2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000093638785 284013768 /nfs/dbraw/zinc/01/37/68/284013768.db2.gz VJRRTZZSAQIOLF-FUZMGVLZSA-N 2 1 317.433 3.270 10 5 DGBEMP CC[NH+]1CC[C@H]([N@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000093638785 284013772 /nfs/dbraw/zinc/01/37/72/284013772.db2.gz VJRRTZZSAQIOLF-FUZMGVLZSA-N 2 1 317.433 3.270 10 5 DGBEMP CC[NH+]1CC[C@H]([N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000093638785 284013775 /nfs/dbraw/zinc/01/37/75/284013775.db2.gz VJRRTZZSAQIOLF-FUZMGVLZSA-N 2 1 317.433 3.270 10 5 DGBEMP Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000183360897 432286551 /nfs/dbraw/zinc/28/65/51/432286551.db2.gz QOSFZJRJQWVYBS-QGZVFWFLSA-N 2 1 317.433 3.354 10 5 DGBEMP Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000183360897 432286553 /nfs/dbraw/zinc/28/65/53/432286553.db2.gz QOSFZJRJQWVYBS-QGZVFWFLSA-N 2 1 317.433 3.354 10 5 DGBEMP CC[N@@H+]1CC[C@H]([NH+](C)C/C=C\c2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000255375627 285151154 /nfs/dbraw/zinc/15/11/54/285151154.db2.gz VJRRTZZSAQIOLF-OWWQLCIYSA-N 2 1 317.433 3.270 10 5 DGBEMP CC[N@H+]1CC[C@H]([NH+](C)C/C=C\c2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000255375627 285151156 /nfs/dbraw/zinc/15/11/56/285151156.db2.gz VJRRTZZSAQIOLF-OWWQLCIYSA-N 2 1 317.433 3.270 10 5 DGBEMP CC[NH+]1CC[C@H]([N@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000255375627 285151159 /nfs/dbraw/zinc/15/11/59/285151159.db2.gz VJRRTZZSAQIOLF-OWWQLCIYSA-N 2 1 317.433 3.270 10 5 DGBEMP CC[NH+]1CC[C@H]([N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000255375627 285151162 /nfs/dbraw/zinc/15/11/62/285151162.db2.gz VJRRTZZSAQIOLF-OWWQLCIYSA-N 2 1 317.433 3.270 10 5 DGBEMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000245724953 432858945 /nfs/dbraw/zinc/85/89/45/432858945.db2.gz IPYSIQWIIJLGJM-HOCLYGCPSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000245724953 432858946 /nfs/dbraw/zinc/85/89/46/432858946.db2.gz IPYSIQWIIJLGJM-HOCLYGCPSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000245724953 432858948 /nfs/dbraw/zinc/85/89/48/432858948.db2.gz IPYSIQWIIJLGJM-HOCLYGCPSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000245724953 432858950 /nfs/dbraw/zinc/85/89/50/432858950.db2.gz IPYSIQWIIJLGJM-HOCLYGCPSA-N 2 1 305.422 3.065 10 5 DGBEMP Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000183370789 432286526 /nfs/dbraw/zinc/28/65/26/432286526.db2.gz NOKNKWHOLVFYGL-INIZCTEOSA-N 2 1 317.433 3.211 10 5 DGBEMP Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000183370789 432286530 /nfs/dbraw/zinc/28/65/30/432286530.db2.gz NOKNKWHOLVFYGL-INIZCTEOSA-N 2 1 317.433 3.211 10 5 DGBEMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+](C)[C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000470181808 533383277 /nfs/dbraw/zinc/38/32/77/533383277.db2.gz HDHZTLGEYDYRCA-PVLDGPILSA-N 2 1 317.433 3.413 10 5 DGBEMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+](C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000470181808 533383280 /nfs/dbraw/zinc/38/32/80/533383280.db2.gz HDHZTLGEYDYRCA-PVLDGPILSA-N 2 1 317.433 3.413 10 5 DGBEMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@@H]1CC[NH+](C)[C@H](C)C1 ZINC000470181808 533383285 /nfs/dbraw/zinc/38/32/85/533383285.db2.gz HDHZTLGEYDYRCA-PVLDGPILSA-N 2 1 317.433 3.413 10 5 DGBEMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@@H]1CC[NH+](C)[C@H](C)C1 ZINC000470181808 533383289 /nfs/dbraw/zinc/38/32/89/533383289.db2.gz HDHZTLGEYDYRCA-PVLDGPILSA-N 2 1 317.433 3.413 10 5 DGBEMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000093638945 193278077 /nfs/dbraw/zinc/27/80/77/193278077.db2.gz IPYSIQWIIJLGJM-GDBMZVCRSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000093638945 193278078 /nfs/dbraw/zinc/27/80/78/193278078.db2.gz IPYSIQWIIJLGJM-GDBMZVCRSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000093638945 193278080 /nfs/dbraw/zinc/27/80/80/193278080.db2.gz IPYSIQWIIJLGJM-GDBMZVCRSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000093638945 193278081 /nfs/dbraw/zinc/27/80/81/193278081.db2.gz IPYSIQWIIJLGJM-GDBMZVCRSA-N 2 1 305.422 3.065 10 5 DGBEMP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000183375858 432286139 /nfs/dbraw/zinc/28/61/39/432286139.db2.gz RGAZJPSVZWKCOI-OAHLLOKOSA-N 2 1 305.422 3.067 10 5 DGBEMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000183375858 432286144 /nfs/dbraw/zinc/28/61/44/432286144.db2.gz RGAZJPSVZWKCOI-OAHLLOKOSA-N 2 1 305.422 3.067 10 5 DGBEMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000183375858 432286146 /nfs/dbraw/zinc/28/61/46/432286146.db2.gz RGAZJPSVZWKCOI-OAHLLOKOSA-N 2 1 305.422 3.067 10 5 DGBEMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000183375858 432286149 /nfs/dbraw/zinc/28/61/49/432286149.db2.gz RGAZJPSVZWKCOI-OAHLLOKOSA-N 2 1 305.422 3.067 10 5 DGBEMP O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2Cn2ccnc2)c(Cl)c1 ZINC000185224060 432479394 /nfs/dbraw/zinc/47/93/94/432479394.db2.gz JZCYBORSZCLQKZ-CQSZACIVSA-N 2 1 320.780 3.109 10 5 DGBEMP O=[N+]([O-])c1ccc(CN2CCC[C@@H]2Cn2ccnc2)c(Cl)c1 ZINC000185224060 432479400 /nfs/dbraw/zinc/47/94/00/432479400.db2.gz JZCYBORSZCLQKZ-CQSZACIVSA-N 2 1 320.780 3.109 10 5 DGBEMP C[NH+](C)CCCC1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000123484503 431866867 /nfs/dbraw/zinc/86/68/67/431866867.db2.gz GIJFYPCAIWUJIO-UHFFFAOYSA-N 2 1 311.451 3.210 10 5 DGBEMP O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000047968232 431917946 /nfs/dbraw/zinc/91/79/46/431917946.db2.gz XKQQXVGMUNOSNT-UHFFFAOYSA-N 2 1 321.396 3.042 10 5 DGBEMP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000183375833 432286590 /nfs/dbraw/zinc/28/65/90/432286590.db2.gz RGAZJPSVZWKCOI-HNNXBMFYSA-N 2 1 305.422 3.067 10 5 DGBEMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000183375833 432286592 /nfs/dbraw/zinc/28/65/92/432286592.db2.gz RGAZJPSVZWKCOI-HNNXBMFYSA-N 2 1 305.422 3.067 10 5 DGBEMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000183375833 432286594 /nfs/dbraw/zinc/28/65/94/432286594.db2.gz RGAZJPSVZWKCOI-HNNXBMFYSA-N 2 1 305.422 3.067 10 5 DGBEMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000183375833 432286597 /nfs/dbraw/zinc/28/65/97/432286597.db2.gz RGAZJPSVZWKCOI-HNNXBMFYSA-N 2 1 305.422 3.067 10 5 DGBEMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000174771543 198382793 /nfs/dbraw/zinc/38/27/93/198382793.db2.gz IIJPSWOQHYXWQY-CJNGLKHVSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000174771543 198382795 /nfs/dbraw/zinc/38/27/95/198382795.db2.gz IIJPSWOQHYXWQY-CJNGLKHVSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000174771543 198382796 /nfs/dbraw/zinc/38/27/96/198382796.db2.gz IIJPSWOQHYXWQY-CJNGLKHVSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000174771543 198382798 /nfs/dbraw/zinc/38/27/98/198382798.db2.gz IIJPSWOQHYXWQY-CJNGLKHVSA-N 2 1 305.422 3.065 10 5 DGBEMP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000247962764 432255747 /nfs/dbraw/zinc/25/57/47/432255747.db2.gz GKGWBQGWMJORQE-KMFMINBZSA-N 2 1 303.406 3.072 10 5 DGBEMP C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000247962764 432255752 /nfs/dbraw/zinc/25/57/52/432255752.db2.gz GKGWBQGWMJORQE-KMFMINBZSA-N 2 1 303.406 3.072 10 5 DGBEMP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000247962764 432255755 /nfs/dbraw/zinc/25/57/55/432255755.db2.gz GKGWBQGWMJORQE-KMFMINBZSA-N 2 1 303.406 3.072 10 5 DGBEMP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000247962764 432255759 /nfs/dbraw/zinc/25/57/59/432255759.db2.gz GKGWBQGWMJORQE-KMFMINBZSA-N 2 1 303.406 3.072 10 5 DGBEMP Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000183370761 432287226 /nfs/dbraw/zinc/28/72/26/432287226.db2.gz NOKNKWHOLVFYGL-MRXNPFEDSA-N 2 1 317.433 3.211 10 5 DGBEMP Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000183370761 432287230 /nfs/dbraw/zinc/28/72/30/432287230.db2.gz NOKNKWHOLVFYGL-MRXNPFEDSA-N 2 1 317.433 3.211 10 5 DGBEMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000245724946 432859530 /nfs/dbraw/zinc/85/95/30/432859530.db2.gz IPYSIQWIIJLGJM-GOEBONIOSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000245724946 432859532 /nfs/dbraw/zinc/85/95/32/432859532.db2.gz IPYSIQWIIJLGJM-GOEBONIOSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000245724946 432859535 /nfs/dbraw/zinc/85/95/35/432859535.db2.gz IPYSIQWIIJLGJM-GOEBONIOSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000245724946 432859536 /nfs/dbraw/zinc/85/95/36/432859536.db2.gz IPYSIQWIIJLGJM-GOEBONIOSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[N@@H+]1CC[C@H]([NH+](C)C/C=C/c2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245786945 401015012 /nfs/dbraw/zinc/01/50/12/401015012.db2.gz VJRRTZZSAQIOLF-OJJSLQOQSA-N 2 1 317.433 3.270 10 5 DGBEMP CC[N@H+]1CC[C@H]([NH+](C)C/C=C/c2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245786945 401015029 /nfs/dbraw/zinc/01/50/29/401015029.db2.gz VJRRTZZSAQIOLF-OJJSLQOQSA-N 2 1 317.433 3.270 10 5 DGBEMP CC[NH+]1CC[C@H]([N@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245786945 401015036 /nfs/dbraw/zinc/01/50/36/401015036.db2.gz VJRRTZZSAQIOLF-OJJSLQOQSA-N 2 1 317.433 3.270 10 5 DGBEMP CC[NH+]1CC[C@H]([N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245786945 401015044 /nfs/dbraw/zinc/01/50/44/401015044.db2.gz VJRRTZZSAQIOLF-OJJSLQOQSA-N 2 1 317.433 3.270 10 5 DGBEMP C[NH2+]CCC1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000157896281 521985360 /nfs/dbraw/zinc/98/53/60/521985360.db2.gz VXMAIPCIVJKLNY-UHFFFAOYSA-N 2 1 311.813 3.070 10 5 DGBEMP C[C@H](c1cccc([N+](=O)[O-])c1)N(C)CC[C@H]1CCCC[N@H+]1C ZINC000248446509 432291767 /nfs/dbraw/zinc/29/17/67/432291767.db2.gz MZODIGWTAHCBTL-GDBMZVCRSA-N 2 1 305.422 3.462 10 5 DGBEMP O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000171671583 432157952 /nfs/dbraw/zinc/15/79/52/432157952.db2.gz RZQZSPGFSSNHTQ-UHFFFAOYSA-N 2 1 321.396 3.042 10 5 DGBEMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000183363553 432287067 /nfs/dbraw/zinc/28/70/67/432287067.db2.gz PALBVRRYWHVXEW-PBHICJAKSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000183363553 432287070 /nfs/dbraw/zinc/28/70/70/432287070.db2.gz PALBVRRYWHVXEW-PBHICJAKSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000183363553 432287073 /nfs/dbraw/zinc/28/70/73/432287073.db2.gz PALBVRRYWHVXEW-PBHICJAKSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000183363553 432287075 /nfs/dbraw/zinc/28/70/75/432287075.db2.gz PALBVRRYWHVXEW-PBHICJAKSA-N 2 1 305.422 3.065 10 5 DGBEMP Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000183643154 432312453 /nfs/dbraw/zinc/31/24/53/432312453.db2.gz ARENTLMMUWJXCT-UHFFFAOYSA-N 2 1 305.422 3.302 10 5 DGBEMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+](C)[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000470181809 533406323 /nfs/dbraw/zinc/40/63/23/533406323.db2.gz HDHZTLGEYDYRCA-SDIQTFFVSA-N 2 1 317.433 3.413 10 5 DGBEMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+](C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000470181809 533406329 /nfs/dbraw/zinc/40/63/29/533406329.db2.gz HDHZTLGEYDYRCA-SDIQTFFVSA-N 2 1 317.433 3.413 10 5 DGBEMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@@H]1CC[NH+](C)[C@@H](C)C1 ZINC000470181809 533406335 /nfs/dbraw/zinc/40/63/35/533406335.db2.gz HDHZTLGEYDYRCA-SDIQTFFVSA-N 2 1 317.433 3.413 10 5 DGBEMP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@@H]1CC[NH+](C)[C@@H](C)C1 ZINC000470181809 533406339 /nfs/dbraw/zinc/40/63/39/533406339.db2.gz HDHZTLGEYDYRCA-SDIQTFFVSA-N 2 1 317.433 3.413 10 5 DGBEMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc([N+](=O)[O-])cc1 ZINC000131794126 196200251 /nfs/dbraw/zinc/20/02/51/196200251.db2.gz JCCKBLYOVFDCOX-JATKITJMSA-N 2 1 303.406 3.261 10 5 DGBEMP C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)CC[C@H]1CCCC[N@H+]1C ZINC000248446512 432292036 /nfs/dbraw/zinc/29/20/36/432292036.db2.gz MZODIGWTAHCBTL-GOEBONIOSA-N 2 1 305.422 3.462 10 5 DGBEMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000174771555 198382837 /nfs/dbraw/zinc/38/28/37/198382837.db2.gz IIJPSWOQHYXWQY-CZUORRHYSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000174771555 198382839 /nfs/dbraw/zinc/38/28/39/198382839.db2.gz IIJPSWOQHYXWQY-CZUORRHYSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000174771555 198382840 /nfs/dbraw/zinc/38/28/40/198382840.db2.gz IIJPSWOQHYXWQY-CZUORRHYSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000174771555 198382842 /nfs/dbraw/zinc/38/28/42/198382842.db2.gz IIJPSWOQHYXWQY-CZUORRHYSA-N 2 1 305.422 3.065 10 5 DGBEMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+](C)[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000470181807 533382790 /nfs/dbraw/zinc/38/27/90/533382790.db2.gz HDHZTLGEYDYRCA-GEZHENHXSA-N 2 1 317.433 3.413 10 5 DGBEMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+](C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000470181807 533382797 /nfs/dbraw/zinc/38/27/97/533382797.db2.gz HDHZTLGEYDYRCA-GEZHENHXSA-N 2 1 317.433 3.413 10 5 DGBEMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@@H]1CC[NH+](C)[C@@H](C)C1 ZINC000470181807 533382799 /nfs/dbraw/zinc/38/27/99/533382799.db2.gz HDHZTLGEYDYRCA-GEZHENHXSA-N 2 1 317.433 3.413 10 5 DGBEMP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@@H]1CC[NH+](C)[C@@H](C)C1 ZINC000470181807 533382803 /nfs/dbraw/zinc/38/28/03/533382803.db2.gz HDHZTLGEYDYRCA-GEZHENHXSA-N 2 1 317.433 3.413 10 5 DGBEMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000248630577 432308202 /nfs/dbraw/zinc/30/82/02/432308202.db2.gz PALBVRRYWHVXEW-YOEHRIQHSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000248630577 432308205 /nfs/dbraw/zinc/30/82/05/432308205.db2.gz PALBVRRYWHVXEW-YOEHRIQHSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000248630577 432308207 /nfs/dbraw/zinc/30/82/07/432308207.db2.gz PALBVRRYWHVXEW-YOEHRIQHSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000248630577 432308212 /nfs/dbraw/zinc/30/82/12/432308212.db2.gz PALBVRRYWHVXEW-YOEHRIQHSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000245422012 432829068 /nfs/dbraw/zinc/82/90/68/432829068.db2.gz IIJPSWOQHYXWQY-XJKSGUPXSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000245422012 432829071 /nfs/dbraw/zinc/82/90/71/432829071.db2.gz IIJPSWOQHYXWQY-XJKSGUPXSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000245422012 432829074 /nfs/dbraw/zinc/82/90/74/432829074.db2.gz IIJPSWOQHYXWQY-XJKSGUPXSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000245422012 432829075 /nfs/dbraw/zinc/82/90/75/432829075.db2.gz IIJPSWOQHYXWQY-XJKSGUPXSA-N 2 1 305.422 3.065 10 5 DGBEMP CC[N@@H+]1CC[C@H]([NH+](C)C/C=C\c2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000255375624 285151186 /nfs/dbraw/zinc/15/11/86/285151186.db2.gz VJRRTZZSAQIOLF-GPXGYGPYSA-N 2 1 317.433 3.270 10 5 DGBEMP CC[N@H+]1CC[C@H]([NH+](C)C/C=C\c2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000255375624 285151188 /nfs/dbraw/zinc/15/11/88/285151188.db2.gz VJRRTZZSAQIOLF-GPXGYGPYSA-N 2 1 317.433 3.270 10 5 DGBEMP CC[NH+]1CC[C@H]([N@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000255375624 285151189 /nfs/dbraw/zinc/15/11/89/285151189.db2.gz VJRRTZZSAQIOLF-GPXGYGPYSA-N 2 1 317.433 3.270 10 5 DGBEMP CC[NH+]1CC[C@H]([N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000255375624 285151191 /nfs/dbraw/zinc/15/11/91/285151191.db2.gz VJRRTZZSAQIOLF-GPXGYGPYSA-N 2 1 317.433 3.270 10 5 DGBEMP