smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cc(OC)cc(N2CCC([NH2+][C@H](C)c3cnn(C(C)C)c3)CC2)c1	ZINC000160992310	567848470	/nfs/dbraw/zinc/84/84/70/567848470.db2.gz	WMRVBVRBFLFZGT-MRXNPFEDSA-N	1	0	372.513	3.801	20	70		FHIDRO
CC(C)(C)C(=O)N1CCC(C[N@@H+]2CCc3c4ccccc4[nH]c3C2)CC1	ZINC000161133214	567875148	/nfs/dbraw/zinc/87/51/48/567875148.db2.gz	OTRVHLOKVSNOIX-UHFFFAOYSA-N	1	0	353.510	3.811	20	70		FHIDRO
COc1cc(Cl)ccc1CNC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1	ZINC000159413772	568292555	/nfs/dbraw/zinc/29/25/55/568292555.db2.gz	HVQPLXGUXAISQH-QGZVFWFLSA-N	1	0	365.905	3.509	20	70		FHIDRO
CC(C)[C@@H]1OCC[C@@H]1C[NH2+]C1CCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000160874285	567825471	/nfs/dbraw/zinc/82/54/71/567825471.db2.gz	HITQHQZDYWBUEL-APWZRJJASA-N	1	0	364.917	3.595	20	70		FHIDRO
O=C(Nc1ccccc1OCC(F)F)N1CCC([NH2+]C2CCCC2)CC1	ZINC000161192132	567881629	/nfs/dbraw/zinc/88/16/29/567881629.db2.gz	FCJNSDRQARZWOQ-UHFFFAOYSA-N	1	0	367.440	3.859	20	70		FHIDRO
Cc1ccc2c(c1)[C@H]([NH2+]CCCc1nnc3n1CCCCC3)CCCO2	ZINC000161157602	567882896	/nfs/dbraw/zinc/88/28/96/567882896.db2.gz	DZUAYEPLEHQZQO-GOSISDBHSA-N	1	0	354.498	3.749	20	70		FHIDRO
CN(C(=O)CCCc1ccc(Br)s1)C1C[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000161399825	567917497	/nfs/dbraw/zinc/91/74/97/567917497.db2.gz	MGAIHIIWEQWGSP-FUNVUKJBSA-N	1	0	371.344	3.575	20	70		FHIDRO
CC(C)[C@@H]1C[N@H+](C)CCN1C(=O)N[C@@H](C)c1nc(-c2ccccc2)cs1	ZINC000159372239	568216270	/nfs/dbraw/zinc/21/62/70/568216270.db2.gz	UZEHWLLYVHIWIW-YJBOKZPZSA-N	1	0	372.538	3.853	20	70		FHIDRO
C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CCC[C@@H]([NH+]2CCCC2)C1	ZINC000159394544	568245738	/nfs/dbraw/zinc/24/57/38/568245738.db2.gz	UCPJZZTWFWOKKV-MAUKXSAKSA-N	1	0	368.443	3.971	20	70		FHIDRO
O=C(c1cc(-c2ccc(F)cc2)on1)N1CCC([NH2+]C2CCCC2)CC1	ZINC000160825206	567818660	/nfs/dbraw/zinc/81/86/60/567818660.db2.gz	HWOCAZGKCWBEEK-UHFFFAOYSA-N	1	0	357.429	3.618	20	70		FHIDRO
CCc1ccc([C@H]2C[C@H](C)CCN2C(=O)Nc2ccn(CC[NH+](C)C)n2)o1	ZINC000161093305	567865439	/nfs/dbraw/zinc/86/54/39/567865439.db2.gz	LBTZRIPVKZALNS-NVXWUHKLSA-N	1	0	373.501	3.605	20	70		FHIDRO
CC(C)CCN(C(=O)NC1CC[NH+]([C@H](C)c2ccncc2)CC1)C1CC1	ZINC000161335306	567910902	/nfs/dbraw/zinc/91/09/02/567910902.db2.gz	VVDGTFCHMNYWKQ-QGZVFWFLSA-N	1	0	358.530	3.827	20	70		FHIDRO
O=C1[C@@H](N2CCC[C@@H](C[NH+]3CCCCCC3)C2)CCN1c1ccccc1F	ZINC000217162948	206363053	/nfs/dbraw/zinc/36/30/53/206363053.db2.gz	UBVFEVWSHCQMHH-RXVVDRJESA-N	1	0	373.516	3.519	20	70		FHIDRO
O=C1[C@H](N2CCC[C@@H](C[NH+]3CCCCCC3)C2)CCN1c1ccccc1F	ZINC000217162957	206363102	/nfs/dbraw/zinc/36/31/02/206363102.db2.gz	UBVFEVWSHCQMHH-GHTZIAJQSA-N	1	0	373.516	3.519	20	70		FHIDRO
C[C@@H]([NH2+][C@@H](C)C(=O)Nc1cccnc1Cl)c1ccccc1-n1cccn1	ZINC000160876349	567825841	/nfs/dbraw/zinc/82/58/41/567825841.db2.gz	PSLNBYVGVKQTJW-KGLIPLIRSA-N	1	0	369.856	3.599	20	70		FHIDRO
COc1ccc(CCCC(=O)N2CCC([N@@H+]3CCC[C@H]3C)CC2)c(OC)c1	ZINC000160961931	567841788	/nfs/dbraw/zinc/84/17/88/567841788.db2.gz	YYRNMYNLJZZOLI-QGZVFWFLSA-N	1	0	374.525	3.502	20	70		FHIDRO
CC(C)[C@H]1C[N@H+](C)CCN1C(=O)N[C@@H](C)c1nc(-c2ccccc2)cs1	ZINC000159372378	568216345	/nfs/dbraw/zinc/21/63/45/568216345.db2.gz	UZEHWLLYVHIWIW-MAUKXSAKSA-N	1	0	372.538	3.853	20	70		FHIDRO
CC(C)[C@@H]1OCC[C@H]1C[NH2+]C1CCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000160874033	567825548	/nfs/dbraw/zinc/82/55/48/567825548.db2.gz	HITQHQZDYWBUEL-LPHOPBHVSA-N	1	0	364.917	3.595	20	70		FHIDRO
COc1ccc(NC(=O)N(C)CC2CCN(c3cc[nH+]cc3)CC2)c(C)c1	ZINC000160993166	567848593	/nfs/dbraw/zinc/84/85/93/567848593.db2.gz	CVCLDYLBGPOKDJ-UHFFFAOYSA-N	1	0	368.481	3.779	20	70		FHIDRO
CCc1ccc([C@H]2C[C@@H](C)CCN2C(=O)Nc2ccn(CC[NH+](C)C)n2)o1	ZINC000161093525	567865383	/nfs/dbraw/zinc/86/53/83/567865383.db2.gz	LBTZRIPVKZALNS-DOTOQJQBSA-N	1	0	373.501	3.605	20	70		FHIDRO
Cc1ccc2c(c1)[C@@H]([NH2+]CCCc1nnc3n1CCCCC3)CCCO2	ZINC000161157735	567882975	/nfs/dbraw/zinc/88/29/75/567882975.db2.gz	DZUAYEPLEHQZQO-SFHVURJKSA-N	1	0	354.498	3.749	20	70		FHIDRO
CN(C(=O)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1)C1C[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000161488526	567944274	/nfs/dbraw/zinc/94/42/74/567944274.db2.gz	FRHRCJGISAXSPJ-PFUJJPPESA-N	1	0	352.400	3.550	20	70		FHIDRO
Cc1cccc(OC2CC[NH+](CC3CCN(C(=O)C(C)(C)C)CC3)CC2)n1	ZINC000161403686	567918884	/nfs/dbraw/zinc/91/88/84/567918884.db2.gz	GTAODJCFXDNSTH-UHFFFAOYSA-N	1	0	373.541	3.518	20	70		FHIDRO
COc1ccc2c(c1)[C@H]([NH2+]C1CCN(C(=O)c3ccc(C)cc3)CC1)CC2	ZINC000160983438	567846979	/nfs/dbraw/zinc/84/69/79/567846979.db2.gz	RTSFPZCIYZXJJX-JOCHJYFZSA-N	1	0	364.489	3.885	20	70		FHIDRO
COc1cc(OC)cc(N2CCC([NH2+][C@@H](C)c3cncc(F)c3)CC2)c1	ZINC000160987581	567847408	/nfs/dbraw/zinc/84/74/08/567847408.db2.gz	VMLAKSAWUWZMLF-AWEZNQCLSA-N	1	0	359.445	3.558	20	70		FHIDRO
COc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C2CCN(C)CC2)CCC3)cc1	ZINC000161488030	567944236	/nfs/dbraw/zinc/94/42/36/567944236.db2.gz	HMXYGYDEHHBUNO-KRWDZBQOSA-N	1	0	357.523	3.880	20	70		FHIDRO
CC[C@H](CC(=O)N1CCN(C[C@@H]2CCCC[N@@H+]2C)CC1)c1ccc(C)cc1	ZINC000159382032	568230746	/nfs/dbraw/zinc/23/07/46/568230746.db2.gz	AOOORQYASKDSLL-IRLDBZIGSA-N	1	0	371.569	3.507	20	70		FHIDRO
C[C@@H]1CCC[N@@H+]1C1CCN(C(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)CC1	ZINC000160857967	567822552	/nfs/dbraw/zinc/82/25/52/567822552.db2.gz	BDGOYMOHBWCLQA-QFUCXCTJSA-N	1	0	371.525	3.565	20	70		FHIDRO
COc1ccc(CCCC(=O)N2CCC([N@@H+]3CCC[C@@H]3C)CC2)c(OC)c1	ZINC000160962056	567841681	/nfs/dbraw/zinc/84/16/81/567841681.db2.gz	YYRNMYNLJZZOLI-KRWDZBQOSA-N	1	0	374.525	3.502	20	70		FHIDRO
COc1ccc2c(c1)[C@@H]([NH2+]C1CCN(C(=O)c3ccc(C)cc3)CC1)CC2	ZINC000160983569	567846975	/nfs/dbraw/zinc/84/69/75/567846975.db2.gz	RTSFPZCIYZXJJX-QFIPXVFZSA-N	1	0	364.489	3.885	20	70		FHIDRO
C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)N1CCC[C@H]([NH+]2CCCC2)C1	ZINC000159400913	568251310	/nfs/dbraw/zinc/25/13/10/568251310.db2.gz	BPWJVIIUNKIKRU-YJBOKZPZSA-N	1	0	368.443	3.971	20	70		FHIDRO
C[NH+](C)Cc1ccc(C(=O)N2CCC(c3c[nH]c4ncccc34)CC2)cc1	ZINC000160907114	567832288	/nfs/dbraw/zinc/83/22/88/567832288.db2.gz	VFEZHBBKDVXMPI-UHFFFAOYSA-N	1	0	362.477	3.644	20	70		FHIDRO
c1ncn(-c2ccc(C[NH+]3CCC(c4nc5ccccc5o4)CC3)cc2)n1	ZINC000161065577	567868124	/nfs/dbraw/zinc/86/81/24/567868124.db2.gz	ISJQFDHSNOACIR-UHFFFAOYSA-N	1	0	359.433	3.788	20	70		FHIDRO
C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)N1CCC[C@@H]([NH+]2CCCC2)C1	ZINC000159401361	568257415	/nfs/dbraw/zinc/25/74/15/568257415.db2.gz	BPWJVIIUNKIKRU-CRAIPNDOSA-N	1	0	368.443	3.971	20	70		FHIDRO
Cc1csc(CNC(=O)N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)n1	ZINC000160853617	567821768	/nfs/dbraw/zinc/82/17/68/567821768.db2.gz	HWQYYWJPTUWXGM-MRXNPFEDSA-N	1	0	364.559	3.638	20	70		FHIDRO
Cc1cc2c(cc1C)[C@@H]([NH2+]Cc1ccccc1CS(C)(=O)=O)CCCO2	ZINC000160944135	567838615	/nfs/dbraw/zinc/83/86/15/567838615.db2.gz	AQACIFQBNULTBK-FQEVSTJZSA-N	1	0	373.518	3.852	20	70		FHIDRO
COc1cc(OC)cc(N2CCC([NH2+][C@H](C)c3cncc(F)c3)CC2)c1	ZINC000160987644	567847443	/nfs/dbraw/zinc/84/74/43/567847443.db2.gz	VMLAKSAWUWZMLF-CQSZACIVSA-N	1	0	359.445	3.558	20	70		FHIDRO
C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)N(C2CC2)C2CCCC2)CC1	ZINC000161164916	567876881	/nfs/dbraw/zinc/87/68/81/567876881.db2.gz	HLTUZKYCJUWXDU-MRXNPFEDSA-N	1	0	356.514	3.724	20	70		FHIDRO
CC(C)CN(C(=O)NC1CC[NH+](C(C)C)CC1)[C@@H]1CCCc2cccnc21	ZINC000161229595	567888879	/nfs/dbraw/zinc/88/88/79/567888879.db2.gz	BSMZTIWECRRRDK-HXUWFJFHSA-N	1	0	372.557	3.999	20	70		FHIDRO
COCCC1(CNC(=O)NC2CC[NH+]([C@H](C)c3ccccc3)CC2)CCC1	ZINC000160881539	567826803	/nfs/dbraw/zinc/82/68/03/567826803.db2.gz	MVZYTPQCZZWMHQ-GOSISDBHSA-N	1	0	373.541	3.718	20	70		FHIDRO
CC(C)CCN(C(=O)NC1CC[NH+]([C@@H](C)c2ccncc2)CC1)C1CC1	ZINC000161335183	567910712	/nfs/dbraw/zinc/91/07/12/567910712.db2.gz	VVDGTFCHMNYWKQ-KRWDZBQOSA-N	1	0	358.530	3.827	20	70		FHIDRO
C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)N1CCC[C@H]([NH+]2CCCC2)C1	ZINC000159401060	568257438	/nfs/dbraw/zinc/25/74/38/568257438.db2.gz	BPWJVIIUNKIKRU-QAPCUYQASA-N	1	0	368.443	3.971	20	70		FHIDRO
C[NH+](C)CCn1cc(NC(=O)Nc2ccc(Cl)cc2-n2cccc2)cn1	ZINC000159445545	568484548	/nfs/dbraw/zinc/48/45/48/568484548.db2.gz	ZXLWVRDVRCKHJB-UHFFFAOYSA-N	1	0	372.860	3.533	20	70		FHIDRO
Cc1ccc(-c2nc(NC(=O)[C@@H]3CCn4ccnc4C3)sc2C)s1	ZINC000161401769	567918024	/nfs/dbraw/zinc/91/80/24/567918024.db2.gz	KFCHGEYNLYEZRD-GFCCVEGCSA-N	1	0	358.492	3.886	20	70		FHIDRO
C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)N1CCC[C@@H]([NH+]2CCCC2)C1	ZINC000159401196	568257417	/nfs/dbraw/zinc/25/74/17/568257417.db2.gz	BPWJVIIUNKIKRU-MAUKXSAKSA-N	1	0	368.443	3.971	20	70		FHIDRO
O=C(/C=C/c1ccc(-n2ccnc2)cc1)N1CCO[C@H](c2cccs2)C1	ZINC000161324356	567906830	/nfs/dbraw/zinc/90/68/30/567906830.db2.gz	PLHOVVHSBVAEIN-MOTZXUDYSA-N	1	0	365.458	3.547	20	70		FHIDRO
O=C(COc1ccccc1C[NH2+][C@H]1CCCc2sccc21)N1CCCC1	ZINC000160960308	567841392	/nfs/dbraw/zinc/84/13/92/567841392.db2.gz	UHGZHQOLDOJWKN-SFHVURJKSA-N	1	0	370.518	3.917	20	70		FHIDRO
CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)Nc2ccn(CC[NH+](C)C)n2)o1	ZINC000161093400	567865421	/nfs/dbraw/zinc/86/54/21/567865421.db2.gz	LBTZRIPVKZALNS-RDJZCZTQSA-N	1	0	373.501	3.605	20	70		FHIDRO
C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)N(C2CC2)C2CCCC2)CC1	ZINC000161164810	567876800	/nfs/dbraw/zinc/87/68/00/567876800.db2.gz	HLTUZKYCJUWXDU-INIZCTEOSA-N	1	0	356.514	3.724	20	70		FHIDRO
Cc1cc(C)n2c(C[NH+]3CCC(c4nc5ccccc5o4)CC3)cnc2n1	ZINC000161058251	567854082	/nfs/dbraw/zinc/85/40/82/567854082.db2.gz	KGQBDFVDWUJORT-UHFFFAOYSA-N	1	0	361.449	3.867	20	70		FHIDRO
CC(C)[C@H]1OCC[C@@H]1C[NH2+]C1CCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000160874158	210247829	/nfs/dbraw/zinc/24/78/29/210247829.db2.gz	HITQHQZDYWBUEL-VQIMIIECSA-N	1	0	364.917	3.595	20	70		FHIDRO
O=C([C@@H]1CCn2ccnc2C1)N1CCCC[C@H]1CCCc1ccccc1	ZINC000161322175	567906347	/nfs/dbraw/zinc/90/63/47/567906347.db2.gz	RWYGQHGJFPWHSG-UXHICEINSA-N	1	0	351.494	3.850	20	70		FHIDRO
CC1CC[NH+](C2CCC(NC(=O)c3cc4c(s3)CCOC4)CC2)CC1	ZINC000161475475	567940321	/nfs/dbraw/zinc/94/03/21/567940321.db2.gz	BHCNGWHGKBWKTA-UHFFFAOYSA-N	1	0	362.539	3.594	20	70		FHIDRO
C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CCC[C@@H]([NH+]2CCCC2)C1	ZINC000159394708	568245698	/nfs/dbraw/zinc/24/56/98/568245698.db2.gz	UCPJZZTWFWOKKV-CRAIPNDOSA-N	1	0	368.443	3.971	20	70		FHIDRO
C[C@@H]([NH2+][C@@H](C)c1ccccc1-n1cccn1)C(=O)Nc1cccnc1Cl	ZINC000160876470	567825824	/nfs/dbraw/zinc/82/58/24/567825824.db2.gz	PSLNBYVGVKQTJW-UONOGXRCSA-N	1	0	369.856	3.599	20	70		FHIDRO
COCCC1(CNC(=O)NC2CC[NH+]([C@@H](C)c3ccccc3)CC2)CCC1	ZINC000160881408	567826872	/nfs/dbraw/zinc/82/68/72/567826872.db2.gz	MVZYTPQCZZWMHQ-SFHVURJKSA-N	1	0	373.541	3.718	20	70		FHIDRO
CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)Nc2ccn(CC[NH+](C)C)n2)o1	ZINC000161093172	567865269	/nfs/dbraw/zinc/86/52/69/567865269.db2.gz	LBTZRIPVKZALNS-WBVHZDCISA-N	1	0	373.501	3.605	20	70		FHIDRO
Cc1ccc(C(C)(C)CN(C)C(=O)c2cccn2C2CC[NH2+]CC2)cc1	ZINC000161256496	567892466	/nfs/dbraw/zinc/89/24/66/567892466.db2.gz	OZMZGSIHEAKIIJ-UHFFFAOYSA-N	1	0	353.510	3.771	20	70		FHIDRO
CC1CC[NH+](C2CCC(NC(=O)c3ccc(-c4ncon4)cc3)CC2)CC1	ZINC000161495556	567945196	/nfs/dbraw/zinc/94/51/96/567945196.db2.gz	GKQDNBSEMOQSSZ-UHFFFAOYSA-N	1	0	368.481	3.510	20	70		FHIDRO
CC1CC[NH+](C2CCC(NC(=O)Cc3noc4ccccc34)CC2)CC1	ZINC000161497778	567945503	/nfs/dbraw/zinc/94/55/03/567945503.db2.gz	SDWYRSHCDBEONU-UHFFFAOYSA-N	1	0	355.482	3.530	20	70		FHIDRO
C[C@@H]([NH2+][C@H](C)c1ccccc1-n1cccn1)C(=O)Nc1cccnc1Cl	ZINC000160876606	567825817	/nfs/dbraw/zinc/82/58/17/567825817.db2.gz	PSLNBYVGVKQTJW-ZIAGYGMSSA-N	1	0	369.856	3.599	20	70		FHIDRO
Cc1noc(C)c1[C@H](C)CC(=O)NC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1	ZINC000161231882	567889274	/nfs/dbraw/zinc/88/92/74/567889274.db2.gz	KDCYLAMBABCJCW-GQIGUUNPSA-N	1	0	369.509	3.812	20	70		FHIDRO
CCCCOc1ccc(/C=C/C(=O)N(C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1OC	ZINC000161368273	567920701	/nfs/dbraw/zinc/92/07/01/567920701.db2.gz	HIIHXPYRYCLDBO-NETUMWRPSA-N	1	0	372.509	3.629	20	70		FHIDRO
COc1cc(OC)cc(N2CCC([NH2+][C@@H](C)c3cnn(C(C)C)c3)CC2)c1	ZINC000160992440	567848513	/nfs/dbraw/zinc/84/85/13/567848513.db2.gz	WMRVBVRBFLFZGT-INIZCTEOSA-N	1	0	372.513	3.801	20	70		FHIDRO
O=C(NC1CC[NH+](Cc2ccc(F)cc2)CC1)c1c(F)cc(F)cc1F	ZINC000161080824	567863061	/nfs/dbraw/zinc/86/30/61/567863061.db2.gz	PHKPSADNTSLPDO-UHFFFAOYSA-N	1	0	366.358	3.637	20	70		FHIDRO
COC(=O)c1cc(C[N@H+](C)CCCC(=O)Nc2c(C)cccc2C)oc1C	ZINC000159405230	568260869	/nfs/dbraw/zinc/26/08/69/568260869.db2.gz	FSPUQCFVXKFSQB-UHFFFAOYSA-N	1	0	372.465	3.842	20	70		FHIDRO
Cc1ccc(OC2CC[NH+](CC3CCN(C(=O)C(C)(C)C)CC3)CC2)nc1	ZINC000161404013	567921183	/nfs/dbraw/zinc/92/11/83/567921183.db2.gz	SQAGEFOESVATMO-UHFFFAOYSA-N	1	0	373.541	3.518	20	70		FHIDRO
COc1ccc(-c2nc3c(s2)[C@H]([NH2+]C2CCN(C)CC2)CCC3)cc1	ZINC000161487902	567944280	/nfs/dbraw/zinc/94/42/80/567944280.db2.gz	HMXYGYDEHHBUNO-QGZVFWFLSA-N	1	0	357.523	3.880	20	70		FHIDRO
CC(C)CN(C(=O)NC1CC[NH+](C(C)C)CC1)[C@H]1CCCc2cccnc21	ZINC000161229720	567888900	/nfs/dbraw/zinc/88/89/00/567888900.db2.gz	BSMZTIWECRRRDK-FQEVSTJZSA-N	1	0	372.557	3.999	20	70		FHIDRO
CC[C@@H](CC(=O)N1CCN(C[C@@H]2CCCC[N@@H+]2C)CC1)c1ccc(C)cc1	ZINC000159381902	568230592	/nfs/dbraw/zinc/23/05/92/568230592.db2.gz	AOOORQYASKDSLL-UNMCSNQZSA-N	1	0	371.569	3.507	20	70		FHIDRO
CC[C@@H](CC(=O)N1CCN(C[C@H]2CCCC[N@@H+]2C)CC1)c1ccc(C)cc1	ZINC000159382161	568230740	/nfs/dbraw/zinc/23/07/40/568230740.db2.gz	AOOORQYASKDSLL-RBBKRZOGSA-N	1	0	371.569	3.507	20	70		FHIDRO
CC(C)[C@H]1OCC[C@@H]1C[NH2+]C1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000160778035	571192460	/nfs/dbraw/zinc/19/24/60/571192460.db2.gz	HSGBWZXVOVRVNL-DNVCBOLYSA-N	1	0	364.917	3.595	20	70		FHIDRO
CC(C)[C@H]1OCC[C@H]1C[NH2+]C1CCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000160873899	567825429	/nfs/dbraw/zinc/82/54/29/567825429.db2.gz	HITQHQZDYWBUEL-QFBILLFUSA-N	1	0	364.917	3.595	20	70		FHIDRO
CCCCOc1ccc(CC[NH2+]C2CCN(C(=O)c3ccco3)CC2)cc1	ZINC000161403560	567918711	/nfs/dbraw/zinc/91/87/11/567918711.db2.gz	SWGHXDAOCYCHOJ-UHFFFAOYSA-N	1	0	370.493	3.895	20	70		FHIDRO
COc1cc(Cl)ccc1CNC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1	ZINC000159413659	568292455	/nfs/dbraw/zinc/29/24/55/568292455.db2.gz	HVQPLXGUXAISQH-KRWDZBQOSA-N	1	0	365.905	3.509	20	70		FHIDRO
O=C(c1ccc(Cl)cc1)N1CCC([NH2+][C@H](CCO)c2ccccc2)CC1	ZINC000161065041	567867999	/nfs/dbraw/zinc/86/79/99/567867999.db2.gz	UJXPCMJKNQUBMG-HXUWFJFHSA-N	1	0	372.896	3.658	20	70		FHIDRO
Cc1noc(C)c1[C@H](C)CC(=O)NC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1	ZINC000161231636	567889306	/nfs/dbraw/zinc/88/93/06/567889306.db2.gz	KDCYLAMBABCJCW-GUXCAODWSA-N	1	0	369.509	3.812	20	70		FHIDRO
CCCOc1ccc(/C=C/C(=O)N(C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1OCC	ZINC000161441668	567933945	/nfs/dbraw/zinc/93/39/45/567933945.db2.gz	YLGUMGBCVFTJHP-NETUMWRPSA-N	1	0	372.509	3.629	20	70		FHIDRO
CC[C@H](CC(=O)N1CCN(C[C@H]2CCCC[N@@H+]2C)CC1)c1ccc(C)cc1	ZINC000159382297	568230768	/nfs/dbraw/zinc/23/07/68/568230768.db2.gz	AOOORQYASKDSLL-IFMALSPDSA-N	1	0	371.569	3.507	20	70		FHIDRO
O=C(COc1ccccc1C[NH2+][C@@H]1CCCc2sccc21)N1CCCC1	ZINC000160960159	567841413	/nfs/dbraw/zinc/84/14/13/567841413.db2.gz	UHGZHQOLDOJWKN-GOSISDBHSA-N	1	0	370.518	3.917	20	70		FHIDRO
C[C@H]([NH2+][C@@H](C)c1ccccc1-n1cccn1)C(=O)Nc1cccnc1Cl	ZINC000160876221	567825885	/nfs/dbraw/zinc/82/58/85/567825885.db2.gz	PSLNBYVGVKQTJW-KBPBESRZSA-N	1	0	369.856	3.599	20	70		FHIDRO
Cc1nc(CCCC(=O)NC2CCC([NH+]3CCC(C)CC3)CC2)cs1	ZINC000161489420	567944403	/nfs/dbraw/zinc/94/44/03/567944403.db2.gz	DHKBXPLWJYWBRB-UHFFFAOYSA-N	1	0	363.571	3.934	20	70		FHIDRO
C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CCC[C@H]([NH+]2CCCC2)C1	ZINC000159394301	568245635	/nfs/dbraw/zinc/24/56/35/568245635.db2.gz	UCPJZZTWFWOKKV-YJBOKZPZSA-N	1	0	368.443	3.971	20	70		FHIDRO
Cc1cc2c(cc1C)[C@H]([NH2+]Cc1ccccc1CS(C)(=O)=O)CCCO2	ZINC000160944272	567838548	/nfs/dbraw/zinc/83/85/48/567838548.db2.gz	AQACIFQBNULTBK-HXUWFJFHSA-N	1	0	373.518	3.852	20	70		FHIDRO
Cc1noc(C)c1[C@H](C)CC(=O)NC1CCC([NH+]2CCC(C)CC2)CC1	ZINC000161400512	567917471	/nfs/dbraw/zinc/91/74/71/567917471.db2.gz	SRFNBUQSUKZJEF-VNCLNFNDSA-N	1	0	361.530	3.944	20	70		FHIDRO
C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CCC[C@H]([NH+]2CCCC2)C1	ZINC000159394418	568245650	/nfs/dbraw/zinc/24/56/50/568245650.db2.gz	UCPJZZTWFWOKKV-QAPCUYQASA-N	1	0	368.443	3.971	20	70		FHIDRO
Cc1csc(CNC(=O)N2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)n1	ZINC000160853469	567821717	/nfs/dbraw/zinc/82/17/17/567821717.db2.gz	HWQYYWJPTUWXGM-INIZCTEOSA-N	1	0	364.559	3.638	20	70		FHIDRO
Cc1noc(C)c1[C@@H](C)CC(=O)NC1CCC([NH+]2CCC(C)CC2)CC1	ZINC000161400376	567917474	/nfs/dbraw/zinc/91/74/74/567917474.db2.gz	SRFNBUQSUKZJEF-MNNVXMFVSA-N	1	0	361.530	3.944	20	70		FHIDRO
Cc1ccc(-c2nc(NC(=O)[C@H]3CCn4ccnc4C3)sc2C)s1	ZINC000161401898	567917948	/nfs/dbraw/zinc/91/79/48/567917948.db2.gz	KFCHGEYNLYEZRD-LBPRGKRZSA-N	1	0	358.492	3.886	20	70		FHIDRO