About N-[(2S)-1-[[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;(2S)-N'-tert-butyl-N-[1-(7-fluoro-3H-indol-2-yl)cyclopropyl]-2-[(4-methylphenyl)sulfonylmethyl]butanediamide;N-[(2S)-4-(2-cyclopropylpyrrolidin-1-yl)-1-[[1-(4-fluoro-1H-benzimidazol-2-yl)cyclopropyl]amino]-1,4-dioxobutan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;2,2-difluoro-N-[(2R)-1-[[(1S)-1-[[1-(4-fluoro-3H-indol-2-yl)cyclopropyl]amino]ethyl]amino]-4-[(2R)-2-methylpiperidin-1-yl]-1,4-dioxobutan-2-yl]spiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(4-fluoro-1H-benzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2S)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2-oxaspiro[3.3]heptane-6-carboxamide;5,5,5-trifluoro-N-[(2S)-1-[[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]pentanamide
N-[(2S)-1-[[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;(2S)-N'-tert-butyl-N-[1-(7-fluoro-3H-indol-2-yl)cyclopropyl]-2-[(4-methylphenyl)sulfonylmethyl]butanediamide;N-[(2S)-4-(2-cyclopropylpyrrolidin-1-yl)-1-[[1-(4-fluoro-1H-benzimidazol-2-yl)cyclopropyl]amino]-1,4-dioxobutan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;2,2-difluoro-N-[(2R)-1-[[(1S)-1-[[1-(4-fluoro-3H-indol-2-yl)cyclopropyl]amino]ethyl]amino]-4-[(2R)-2-methylpiperidin-1-yl]-1,4-dioxobutan-2-yl]spiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(4-fluoro-1H-benzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2S)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2-oxaspiro[3.3]heptane-6-carboxamide;5,5,5-trifluoro-N-[(2S)-1-[[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]pentanamide (PubChem CID 161084615) has the molecular formula C233H270F19N35O28S2
and a molecular weight of 4434.04 g/mol. Its IUPAC name is N-[(2S)-1-[[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;(2S)-N'-tert-butyl-N-[1-(7-fluoro-3H-indol-2-yl)cyclopropyl]-2-[(4-methylphenyl)sulfonylmethyl]butanediamide;N-[(2S)-4-(2-cyclopropylpyrrolidin-1-yl)-1-[[1-(4-fluoro-1H-benzimidazol-2-yl)cyclopropyl]amino]-1,4-dioxobutan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;2,2-difluoro-N-[(2R)-1-[[(1S)-1-[[1-(4-fluoro-3H-indol-2-yl)cyclopropyl]amino]ethyl]amino]-4-[(2R)-2-methylpiperidin-1-yl]-1,4-dioxobutan-2-yl]spiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(4-fluoro-1H-benzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2S)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2-oxaspiro[3.3]heptane-6-carboxamide;5,5,5-trifluoro-N-[(2S)-1-[[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]pentanamide.
Frequently Asked Questions
What is the IUPAC name of N-[(2S)-1-[[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;(2S)-N'-tert-butyl-N-[1-(7-fluoro-3H-indol-2-yl)cyclopropyl]-2-[(4-methylphenyl)sulfonylmethyl]butanediamide;N-[(2S)-4-(2-cyclopropylpyrrolidin-1-yl)-1-[[1-(4-fluoro-1H-benzimidazol-2-yl)cyclopropyl]amino]-1,4-dioxobutan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;2,2-difluoro-N-[(2R)-1-[[(1S)-1-[[1-(4-fluoro-3H-indol-2-yl)cyclopropyl]amino]ethyl]amino]-4-[(2R)-2-methylpiperidin-1-yl]-1,4-dioxobutan-2-yl]spiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(4-fluoro-1H-benzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2S)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2-oxaspiro[3.3]heptane-6-carboxamide;5,5,5-trifluoro-N-[(2S)-1-[[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]pentanamide?
The IUPAC name of N-[(2S)-1-[[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;(2S)-N'-tert-butyl-N-[1-(7-fluoro-3H-indol-2-yl)cyclopropyl]-2-[(4-methylphenyl)sulfonylmethyl]butanediamide;N-[(2S)-4-(2-cyclopropylpyrrolidin-1-yl)-1-[[1-(4-fluoro-1H-benzimidazol-2-yl)cyclopropyl]amino]-1,4-dioxobutan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;2,2-difluoro-N-[(2R)-1-[[(1S)-1-[[1-(4-fluoro-3H-indol-2-yl)cyclopropyl]amino]ethyl]amino]-4-[(2R)-2-methylpiperidin-1-yl]-1,4-dioxobutan-2-yl]spiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(4-fluoro-1H-benzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2S)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2-oxaspiro[3.3]heptane-6-carboxamide;5,5,5-trifluoro-N-[(2S)-1-[[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]pentanamide (CID 161084615) is N-[(2S)-1-[[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;(2S)-N'-tert-butyl-N-[1-(7-fluoro-3H-indol-2-yl)cyclopropyl]-2-[(4-methylphenyl)sulfonylmethyl]butanediamide;N-[(2S)-4-(2-cyclopropylpyrrolidin-1-yl)-1-[[1-(4-fluoro-1H-benzimidazol-2-yl)cyclopropyl]amino]-1,4-dioxobutan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;2,2-difluoro-N-[(2R)-1-[[(1S)-1-[[1-(4-fluoro-3H-indol-2-yl)cyclopropyl]amino]ethyl]amino]-4-[(2R)-2-methylpiperidin-1-yl]-1,4-dioxobutan-2-yl]spiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(4-fluoro-1H-benzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2S)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2-oxaspiro[3.3]heptane-6-carboxamide;5,5,5-trifluoro-N-[(2S)-1-[[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]pentanamide.
What is the SMILES notation for N-[(2S)-1-[[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;(2S)-N'-tert-butyl-N-[1-(7-fluoro-3H-indol-2-yl)cyclopropyl]-2-[(4-methylphenyl)sulfonylmethyl]butanediamide;N-[(2S)-4-(2-cyclopropylpyrrolidin-1-yl)-1-[[1-(4-fluoro-1H-benzimidazol-2-yl)cyclopropyl]amino]-1,4-dioxobutan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;2,2-difluoro-N-[(2R)-1-[[(1S)-1-[[1-(4-fluoro-3H-indol-2-yl)cyclopropyl]amino]ethyl]amino]-4-[(2R)-2-methylpiperidin-1-yl]-1,4-dioxobutan-2-yl]spiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(4-fluoro-1H-benzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2S)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2-oxaspiro[3.3]heptane-6-carboxamide;5,5,5-trifluoro-N-[(2S)-1-[[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]pentanamide?
The canonical SMILES for N-[(2S)-1-[[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;(2S)-N'-tert-butyl-N-[1-(7-fluoro-3H-indol-2-yl)cyclopropyl]-2-[(4-methylphenyl)sulfonylmethyl]butanediamide;N-[(2S)-4-(2-cyclopropylpyrrolidin-1-yl)-1-[[1-(4-fluoro-1H-benzimidazol-2-yl)cyclopropyl]amino]-1,4-dioxobutan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;2,2-difluoro-N-[(2R)-1-[[(1S)-1-[[1-(4-fluoro-3H-indol-2-yl)cyclopropyl]amino]ethyl]amino]-4-[(2R)-2-methylpiperidin-1-yl]-1,4-dioxobutan-2-yl]spiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(4-fluoro-1H-benzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2S)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2-oxaspiro[3.3]heptane-6-carboxamide;5,5,5-trifluoro-N-[(2S)-1-[[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]pentanamide is C[C@H](NC(=O)[C@@H](CC(=O)N1CCCC[C@H]1C)NC(=O)C1CC2(C1)CC(F)(F)C2)NC1(C2=Nc3cccc(F)c3C2)CC1.C[C@H](NC(=O)[C@H](CC(=O)N1CCC[C@@H]1c1ccccc1)NC(=O)C1CC2(C1)CC(F)(F)C2)c1nc2ccccc2o1.C[C@H](NC(=O)[C@H](CC(=O)N1CCC[C@@H]1c1ccccc1)NC(=O)CCCC(F)(F)F)c1nc2ccccc2n1C.C[C@H](NC(=O)[C@H](CC(=O)N1CCC[C@@H]1c1ccccc1)NC(=O)CCCC(F)(F)F)c1nc2ccccc2o1.C[C@H](NC(=O)[C@H](CC(=O)N1CCC[C@@H]1c1ccccc1)NC(=O)CCCC(F)(F)F)c1nc2ccccc2s1.C[C@H](NC(=O)[C@H](CC(=O)N1CCC[C@H]1c1ccccc1)NC(=O)C1CC2(COC2)C1)c1nc2c(F)cccc2[nH]1.Cc1ccc(S(=O)(=O)C[C@@H](CC(=O)NC(C)(C)C)C(=O)NC2(C3=Nc4c(F)cccc4C3)CC2)cc1.O=C(N[C@@H](CC(=O)N1CCCC1C1CC1)C(=O)NC1(c2nc3c(F)cccc3[nH]2)CC1)C1CC2(C1)CC(F)(F)C2.
What is the InChIKey of N-[(2S)-1-[[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;(2S)-N'-tert-butyl-N-[1-(7-fluoro-3H-indol-2-yl)cyclopropyl]-2-[(4-methylphenyl)sulfonylmethyl]butanediamide;N-[(2S)-4-(2-cyclopropylpyrrolidin-1-yl)-1-[[1-(4-fluoro-1H-benzimidazol-2-yl)cyclopropyl]amino]-1,4-dioxobutan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;2,2-difluoro-N-[(2R)-1-[[(1S)-1-[[1-(4-fluoro-3H-indol-2-yl)cyclopropyl]amino]ethyl]amino]-4-[(2R)-2-methylpiperidin-1-yl]-1,4-dioxobutan-2-yl]spiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(4-fluoro-1H-benzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2S)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2-oxaspiro[3.3]heptane-6-carboxamide;5,5,5-trifluoro-N-[(2S)-1-[[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]pentanamide?
The InChIKey is UGINBVBHDDABOY-BJDHFAHPSA-N. The full InChI is InChI=1S/C31H40F3N5O3.C31H34F2N4O4.C30H34FN5O4.2C29H34F3N5O3.C28H31F3N4O4.C28H31F3N4O3S.C27H32FN3O4S/c1-18-6-3-4-11-39(18)26(40)13-24(37-27(41)20-14-29(15-20)16-31(33,34)17-29)28(42)35-19(2)38-30(9-10-30)25-12-21-22(32)7-5-8-23(21)36-25;1-19(29-36-22-10-5-6-12-25(22)41-29)34-28(40)23(35-27(39)21-15-30(16-21)17-31(32,33)18-30)14-26(38)37-13-7-11-24(37)20-8-3-2-4-9-20;1-18(27-33-22-10-5-9-21(31)26(22)35-27)32-29(39)23(34-28(38)20-14-30(15-20)16-40-17-30)13-25(37)36-12-6-11-24(36)19-7-3-2-4-8-19;30-18-3-1-4-19-23(18)35-26(34-19)28(8-9-28)36-25(40)20(11-22(38)37-10-2-5-21(37)16-6-7-16)33-24(39)17-12-27(13-17)14-29(31,32)15-27;1-19(27-35-21-12-6-7-13-24(21)36(27)2)33-28(40)22(34-25(38)15-8-16-29(30,31)32)18-26(39)37-17-9-14-23(37)20-10-4-3-5-11-20;2*1-18(27-34-20-11-5-6-13-23(20)39-27)32-26(38)21(33-24(36)14-7-15-28(29,30)31)17-25(37)35-16-8-12-22(35)19-9-3-2-4-10-19;1-17-8-10-20(11-9-17)36(34,35)16-19(15-23(32)30-26(2,3)4)25(33)31-27(12-13-27)22-14-18-6-5-7-21(28)24(18)29-22/h5,7-8,18-20,24,38H,3-4,6,9-17H2,1-2H3,(H,35,42)(H,37,41);2-6,8-10,12,19,21,23-24H,7,11,13-18H2,1H3,(H,34,40)(H,35,39);2-5,7-10,18,20,23-24H,6,11-17H2,1H3,(H,32,39)(H,33,35)(H,34,38);1,3-4,16-17,20-21H,2,5-15H2,(H,33,39)(H,34,35)(H,36,40);3-7,10-13,19,22-23H,8-9,14-18H2,1-2H3,(H,33,40)(H,34,38);2*2-6,9-11,13,18,21-22H,7-8,12,14-17H2,1H3,(H,32,38)(H,33,36);5-11,19H,12-16H2,1-4H3,(H,30,32)(H,31,33)/t18-,19-,24-;19-,23-,24+;18-,23-,24-;20-,21?;19-,22-,23+;2*18-,21-,22+;19-/m10000001/s1.
What are the key properties of N-[(2S)-1-[[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;(2S)-N'-tert-butyl-N-[1-(7-fluoro-3H-indol-2-yl)cyclopropyl]-2-[(4-methylphenyl)sulfonylmethyl]butanediamide;N-[(2S)-4-(2-cyclopropylpyrrolidin-1-yl)-1-[[1-(4-fluoro-1H-benzimidazol-2-yl)cyclopropyl]amino]-1,4-dioxobutan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;2,2-difluoro-N-[(2R)-1-[[(1S)-1-[[1-(4-fluoro-3H-indol-2-yl)cyclopropyl]amino]ethyl]amino]-4-[(2R)-2-methylpiperidin-1-yl]-1,4-dioxobutan-2-yl]spiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(4-fluoro-1H-benzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2S)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2-oxaspiro[3.3]heptane-6-carboxamide;5,5,5-trifluoro-N-[(2S)-1-[[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]pentanamide?
N-[(2S)-1-[[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;(2S)-N'-tert-butyl-N-[1-(7-fluoro-3H-indol-2-yl)cyclopropyl]-2-[(4-methylphenyl)sulfonylmethyl]butanediamide;N-[(2S)-4-(2-cyclopropylpyrrolidin-1-yl)-1-[[1-(4-fluoro-1H-benzimidazol-2-yl)cyclopropyl]amino]-1,4-dioxobutan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;2,2-difluoro-N-[(2R)-1-[[(1S)-1-[[1-(4-fluoro-3H-indol-2-yl)cyclopropyl]amino]ethyl]amino]-4-[(2R)-2-methylpiperidin-1-yl]-1,4-dioxobutan-2-yl]spiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(4-fluoro-1H-benzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2S)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2-oxaspiro[3.3]heptane-6-carboxamide;5,5,5-trifluoro-N-[(2S)-1-[[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]pentanamide has a molecular weight of 4434.04 g/mol, XLogP of 35.61, 71 rotatable bonds, 19 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-[[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(1,3-benzoxazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]-5,5,5-trifluoropentanamide;(2S)-N'-tert-butyl-N-[1-(7-fluoro-3H-indol-2-yl)cyclopropyl]-2-[(4-methylphenyl)sulfonylmethyl]butanediamide;N-[(2S)-4-(2-cyclopropylpyrrolidin-1-yl)-1-[[1-(4-fluoro-1H-benzimidazol-2-yl)cyclopropyl]amino]-1,4-dioxobutan-2-yl]-2,2-difluorospiro[3.3]heptane-6-carboxamide;2,2-difluoro-N-[(2R)-1-[[(1S)-1-[[1-(4-fluoro-3H-indol-2-yl)cyclopropyl]amino]ethyl]amino]-4-[(2R)-2-methylpiperidin-1-yl]-1,4-dioxobutan-2-yl]spiro[3.3]heptane-6-carboxamide;N-[(2S)-1-[[(1S)-1-(4-fluoro-1H-benzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2S)-2-phenylpyrrolidin-1-yl]butan-2-yl]-2-oxaspiro[3.3]heptane-6-carboxamide;5,5,5-trifluoro-N-[(2S)-1-[[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]amino]-1,4-dioxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butan-2-yl]pentanamide is sourced from PubChem (CID 161084615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).