2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-methylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-phenylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;ethyl (1R,2S,5S,6S)-3-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-3-azabicyclo[3.1.0]hexane-6-carboxylate;[(2R)-3-methylbutan-2-yl] N-[(1S)-1-cyclohexyl-2-[2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-2-oxoethyl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-5-methyl-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate

C225H332N34O52 — CID 157071249

IUPAC2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-methylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-phenylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;ethyl (1R,2S,5S,6S)-3-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-3-azabicyclo[3.1.0]hexane-6-carboxylate;[(2R)-3-methylbutan-2-yl] N-[(1S)-1-cyclohexyl-2-[2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-2-oxoethyl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-5-methyl-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate
SMILESCC(C)CC(NC(=O)[C@@H]1CC(C)(C)CN1C(=O)[C@@H](NC(=O)OC(C)C)C(C)(C)C)C(=O)C(=O)NCC(=O)NC(C(=O)N(C)C)c1ccccc1.CCCC(NC(=O)C1CC(C)(C)CN1C(=O)[C@@H](NC(=O)O[C@H](C)C(C)C)C1CCCCC1)C(=O)C(=O)NCC(=O)NC(C(=O)N(C)C)c1ccccc1.CCCC(NC(=O)[C@@H]1CC(C)(C)CN1C(=O)[C@@H](NC(=O)OC(C)C)C(C)(C)C)C(=O)C(=O)NCC(=O)NC(C(=O)N(C)C)c1ccccc1.CCCC(NC(=O)[C@@H]1CC[C@@H](C)N1C(=O)[C@@H](NC(=O)OCC(C)C)C1CCCCC1)C(=O)C(=O)NCC(=O)NC(C(=O)O)c1ccccc1.CCCC(NC(=O)[C@@H]1CC[C@H](c2ccccc2)N1C(=O)[C@@H](NC(=O)OCC(C)C)C1CCCCC1)C(=O)C(=O)NCC(=O)NC(C(=O)O)c1ccccc1.CCCC(NC(=O)[C@@H]1[C@@H]2[C@H](CN1C(=O)[C@@H](NC(=O)OCC(C)C)C1CCCCC1)[C@@H]2C(=O)OCC)C(=O)C(=O)NCC(=O)NC(C(=O)N(C)C)c1ccccc1
InChIInChI=1S/C40H58N6O10.C40H53N5O9.C39H60N6O8.C36H56N6O8.C35H54N6O8.C35H51N5O9/c1-7-15-27(34(48)36(50)41-20-28(47)43-31(37(51)45(5)6)24-16-11-9-12-17-24)42-35(49)33-29-26(30(29)39(53)55-8-2)21-46(33)38(52)32(25-18-13-10-14-19-25)44-40(54)56-22-23(3)4;1-4-14-29(35(47)37(49)41-23-32(46)43-34(39(51)52)28-19-12-7-13-20-28)42-36(48)31-22-21-30(26-15-8-5-9-16-26)45(31)38(50)33(27-17-10-6-11-18-27)44-40(53)54-24-25(2)3;1-9-16-28(33(47)35(49)40-22-30(46)42-31(36(50)44(7)8)26-17-12-10-13-18-26)41-34(48)29-21-39(5,6)23-45(29)37(51)32(27-19-14-11-15-20-27)43-38(52)53-25(4)24(2)3;1-21(2)17-24(28(44)31(46)37-19-26(43)39-27(32(47)41(10)11)23-15-13-12-14-16-23)38-30(45)25-18-36(8,9)20-42(25)33(48)29(35(5,6)7)40-34(49)50-22(3)4;1-11-15-23(27(43)30(45)36-19-25(42)38-26(31(46)40(9)10)22-16-13-12-14-17-22)37-29(44)24-18-35(7,8)20-41(24)32(47)28(34(4,5)6)39-33(48)49-21(2)3;1-5-12-25(30(42)32(44)36-19-27(41)38-29(34(46)47)24-15-10-7-11-16-24)37-31(43)26-18-17-22(4)40(26)33(45)28(23-13-8-6-9-14-23)39-35(48)49-20-21(2)3/h9,11-12,16-17,23,25-27,29-33H,7-8,10,13-15,18-22H2,1-6H3,(H,41,50)(H,42,49)(H,43,47)(H,44,54);5,7-9,12-13,15-16,19-20,25,27,29-31,33-34H,4,6,10-11,14,17-18,21-24H2,1-3H3,(H,41,49)(H,42,48)(H,43,46)(H,44,53)(H,51,52);10,12-13,17-18,24-25,27-29,31-32H,9,11,14-16,19-23H2,1-8H3,(H,40,49)(H,41,48)(H,42,46)(H,43,52);12-16,21-22,24-25,27,29H,17-20H2,1-11H3,(H,37,46)(H,38,45)(H,39,43)(H,40,49);12-14,16-17,21,23-24,26,28H,11,15,18-20H2,1-10H3,(H,36,45)(H,37,44)(H,38,42)(H,39,48);7,10-11,15-16,21-23,25-26,28-29H,5-6,8-9,12-14,17-20H2,1-4H3,(H,36,44)(H,37,43)(H,38,41)(H,39,48)(H,46,47)/t26-,27?,29+,30-,31?,32-,33-;29?,30-,31+,33+,34?;25-,28?,29?,31?,32+;24?,25-,27?,29+;23?,24-,26?,28+;22-,25?,26+,28+,29?/m011001/s1
InChIKeyACLNHVPSRNPOIN-AJQCYSRQSA-N
MW4345.32 g/mol
LogP16.09
Rot. Bonds95

About 2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-methylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-phenylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;ethyl (1R,2S,5S,6S)-3-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-3-azabicyclo[3.1.0]hexane-6-carboxylate;[(2R)-3-methylbutan-2-yl] N-[(1S)-1-cyclohexyl-2-[2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-2-oxoethyl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-5-methyl-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate

2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-methylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-phenylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;ethyl (1R,2S,5S,6S)-3-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-3-azabicyclo[3.1.0]hexane-6-carboxylate;[(2R)-3-methylbutan-2-yl] N-[(1S)-1-cyclohexyl-2-[2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-2-oxoethyl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-5-methyl-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate (PubChem CID 157071249) has the molecular formula C225H332N34O52 and a molecular weight of 4345.32 g/mol. Its IUPAC name is 2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-methylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-phenylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;ethyl (1R,2S,5S,6S)-3-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-3-azabicyclo[3.1.0]hexane-6-carboxylate;[(2R)-3-methylbutan-2-yl] N-[(1S)-1-cyclohexyl-2-[2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-2-oxoethyl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-5-methyl-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate.

Molecular Properties

Compound Name2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-methylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-phenylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;ethyl (1R,2S,5S,6S)-3-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-3-azabicyclo[3.1.0]hexane-6-carboxylate;[(2R)-3-methylbutan-2-yl] N-[(1S)-1-cyclohexyl-2-[2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-2-oxoethyl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-5-methyl-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate
PubChem CID157071249
Molecular FormulaC225H332N34O52
Molecular Weight4345.32 g/mol
Exact Mass4342.44
IUPAC Name2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-methylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-phenylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;ethyl (1R,2S,5S,6S)-3-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-3-azabicyclo[3.1.0]hexane-6-carboxylate;[(2R)-3-methylbutan-2-yl] N-[(1S)-1-cyclohexyl-2-[2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-2-oxoethyl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-5-methyl-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate
SMILESCC(C)CC(NC(=O)[C@@H]1CC(C)(C)CN1C(=O)[C@@H](NC(=O)OC(C)C)C(C)(C)C)C(=O)C(=O)NCC(=O)NC(C(=O)N(C)C)c1ccccc1.CCCC(NC(=O)C1CC(C)(C)CN1C(=O)[C@@H](NC(=O)O[C@H](C)C(C)C)C1CCCCC1)C(=O)C(=O)NCC(=O)NC(C(=O)N(C)C)c1ccccc1.CCCC(NC(=O)[C@@H]1CC(C)(C)CN1C(=O)[C@@H](NC(=O)OC(C)C)C(C)(C)C)C(=O)C(=O)NCC(=O)NC(C(=O)N(C)C)c1ccccc1.CCCC(NC(=O)[C@@H]1CC[C@@H](C)N1C(=O)[C@@H](NC(=O)OCC(C)C)C1CCCCC1)C(=O)C(=O)NCC(=O)NC(C(=O)O)c1ccccc1.CCCC(NC(=O)[C@@H]1CC[C@H](c2ccccc2)N1C(=O)[C@@H](NC(=O)OCC(C)C)C1CCCCC1)C(=O)C(=O)NCC(=O)NC(C(=O)O)c1ccccc1.CCCC(NC(=O)[C@@H]1[C@@H]2[C@H](CN1C(=O)[C@@H](NC(=O)OCC(C)C)C1CCCCC1)[C@@H]2C(=O)OCC)C(=O)C(=O)NCC(=O)NC(C(=O)N(C)C)c1ccccc1
InChIInChI=1S/C40H58N6O10.C40H53N5O9.C39H60N6O8.C36H56N6O8.C35H54N6O8.C35H51N5O9/c1-7-15-27(34(48)36(50)41-20-28(47)43-31(37(51)45(5)6)24-16-11-9-12-17-24)42-35(49)33-29-26(30(29)39(53)55-8-2)21-46(33)38(52)32(25-18-13-10-14-19-25)44-40(54)56-22-23(3)4;1-4-14-29(35(47)37(49)41-23-32(46)43-34(39(51)52)28-19-12-7-13-20-28)42-36(48)31-22-21-30(26-15-8-5-9-16-26)45(31)38(50)33(27-17-10-6-11-18-27)44-40(53)54-24-25(2)3;1-9-16-28(33(47)35(49)40-22-30(46)42-31(36(50)44(7)8)26-17-12-10-13-18-26)41-34(48)29-21-39(5,6)23-45(29)37(51)32(27-19-14-11-15-20-27)43-38(52)53-25(4)24(2)3;1-21(2)17-24(28(44)31(46)37-19-26(43)39-27(32(47)41(10)11)23-15-13-12-14-16-23)38-30(45)25-18-36(8,9)20-42(25)33(48)29(35(5,6)7)40-34(49)50-22(3)4;1-11-15-23(27(43)30(45)36-19-25(42)38-26(31(46)40(9)10)22-16-13-12-14-17-22)37-29(44)24-18-35(7,8)20-41(24)32(47)28(34(4,5)6)39-33(48)49-21(2)3;1-5-12-25(30(42)32(44)36-19-27(41)38-29(34(46)47)24-15-10-7-11-16-24)37-31(43)26-18-17-22(4)40(26)33(45)28(23-13-8-6-9-14-23)39-35(48)49-20-21(2)3/h9,11-12,16-17,23,25-27,29-33H,7-8,10,13-15,18-22H2,1-6H3,(H,41,50)(H,42,49)(H,43,47)(H,44,54);5,7-9,12-13,15-16,19-20,25,27,29-31,33-34H,4,6,10-11,14,17-18,21-24H2,1-3H3,(H,41,49)(H,42,48)(H,43,46)(H,44,53)(H,51,52);10,12-13,17-18,24-25,27-29,31-32H,9,11,14-16,19-23H2,1-8H3,(H,40,49)(H,41,48)(H,42,46)(H,43,52);12-16,21-22,24-25,27,29H,17-20H2,1-11H3,(H,37,46)(H,38,45)(H,39,43)(H,40,49);12-14,16-17,21,23-24,26,28H,11,15,18-20H2,1-10H3,(H,36,45)(H,37,44)(H,38,42)(H,39,48);7,10-11,15-16,21-23,25-26,28-29H,5-6,8-9,12-14,17-20H2,1-4H3,(H,36,44)(H,37,43)(H,38,41)(H,39,48)(H,46,47)/t26-,27?,29+,30-,31?,32-,33-;29?,30-,31+,33+,34?;25-,28?,29?,31?,32+;24?,25-,27?,29+;23?,24-,26?,28+;22-,25?,26+,28+,29?/m011001/s1
InChIKeyACLNHVPSRNPOIN-AJQCYSRQSA-N
XLogP16.09
TPSA1160.20 Ų
H-Bond Donors26
H-Bond Acceptors50
Rotatable Bonds95
Heavy Atoms311
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004345.32
LogP ≤ 516.09
H-Bond Donors ≤ 526
H-Bond Acceptors ≤ 1050

Analyze 2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-methylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-phenylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;ethyl (1R,2S,5S,6S)-3-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-3-azabicyclo[3.1.0]hexane-6-carboxylate;[(2R)-3-methylbutan-2-yl] N-[(1S)-1-cyclohexyl-2-[2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-2-oxoethyl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-5-methyl-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-methylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-phenylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;ethyl (1R,2S,5S,6S)-3-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-3-azabicyclo[3.1.0]hexane-6-carboxylate;[(2R)-3-methylbutan-2-yl] N-[(1S)-1-cyclohexyl-2-[2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-2-oxoethyl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-5-methyl-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate?
The IUPAC name of 2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-methylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-phenylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;ethyl (1R,2S,5S,6S)-3-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-3-azabicyclo[3.1.0]hexane-6-carboxylate;[(2R)-3-methylbutan-2-yl] N-[(1S)-1-cyclohexyl-2-[2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-2-oxoethyl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-5-methyl-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate (CID 157071249) is 2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-methylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-phenylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;ethyl (1R,2S,5S,6S)-3-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-3-azabicyclo[3.1.0]hexane-6-carboxylate;[(2R)-3-methylbutan-2-yl] N-[(1S)-1-cyclohexyl-2-[2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-2-oxoethyl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-5-methyl-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate.
What is the SMILES notation for 2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-methylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-phenylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;ethyl (1R,2S,5S,6S)-3-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-3-azabicyclo[3.1.0]hexane-6-carboxylate;[(2R)-3-methylbutan-2-yl] N-[(1S)-1-cyclohexyl-2-[2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-2-oxoethyl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-5-methyl-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate?
The canonical SMILES for 2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-methylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-phenylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;ethyl (1R,2S,5S,6S)-3-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-3-azabicyclo[3.1.0]hexane-6-carboxylate;[(2R)-3-methylbutan-2-yl] N-[(1S)-1-cyclohexyl-2-[2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-2-oxoethyl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-5-methyl-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate is CC(C)CC(NC(=O)[C@@H]1CC(C)(C)CN1C(=O)[C@@H](NC(=O)OC(C)C)C(C)(C)C)C(=O)C(=O)NCC(=O)NC(C(=O)N(C)C)c1ccccc1.CCCC(NC(=O)C1CC(C)(C)CN1C(=O)[C@@H](NC(=O)O[C@H](C)C(C)C)C1CCCCC1)C(=O)C(=O)NCC(=O)NC(C(=O)N(C)C)c1ccccc1.CCCC(NC(=O)[C@@H]1CC(C)(C)CN1C(=O)[C@@H](NC(=O)OC(C)C)C(C)(C)C)C(=O)C(=O)NCC(=O)NC(C(=O)N(C)C)c1ccccc1.CCCC(NC(=O)[C@@H]1CC[C@@H](C)N1C(=O)[C@@H](NC(=O)OCC(C)C)C1CCCCC1)C(=O)C(=O)NCC(=O)NC(C(=O)O)c1ccccc1.CCCC(NC(=O)[C@@H]1CC[C@H](c2ccccc2)N1C(=O)[C@@H](NC(=O)OCC(C)C)C1CCCCC1)C(=O)C(=O)NCC(=O)NC(C(=O)O)c1ccccc1.CCCC(NC(=O)[C@@H]1[C@@H]2[C@H](CN1C(=O)[C@@H](NC(=O)OCC(C)C)C1CCCCC1)[C@@H]2C(=O)OCC)C(=O)C(=O)NCC(=O)NC(C(=O)N(C)C)c1ccccc1.
What is the InChIKey of 2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-methylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-phenylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;ethyl (1R,2S,5S,6S)-3-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-3-azabicyclo[3.1.0]hexane-6-carboxylate;[(2R)-3-methylbutan-2-yl] N-[(1S)-1-cyclohexyl-2-[2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-2-oxoethyl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-5-methyl-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate?
The InChIKey is ACLNHVPSRNPOIN-AJQCYSRQSA-N. The full InChI is InChI=1S/C40H58N6O10.C40H53N5O9.C39H60N6O8.C36H56N6O8.C35H54N6O8.C35H51N5O9/c1-7-15-27(34(48)36(50)41-20-28(47)43-31(37(51)45(5)6)24-16-11-9-12-17-24)42-35(49)33-29-26(30(29)39(53)55-8-2)21-46(33)38(52)32(25-18-13-10-14-19-25)44-40(54)56-22-23(3)4;1-4-14-29(35(47)37(49)41-23-32(46)43-34(39(51)52)28-19-12-7-13-20-28)42-36(48)31-22-21-30(26-15-8-5-9-16-26)45(31)38(50)33(27-17-10-6-11-18-27)44-40(53)54-24-25(2)3;1-9-16-28(33(47)35(49)40-22-30(46)42-31(36(50)44(7)8)26-17-12-10-13-18-26)41-34(48)29-21-39(5,6)23-45(29)37(51)32(27-19-14-11-15-20-27)43-38(52)53-25(4)24(2)3;1-21(2)17-24(28(44)31(46)37-19-26(43)39-27(32(47)41(10)11)23-15-13-12-14-16-23)38-30(45)25-18-36(8,9)20-42(25)33(48)29(35(5,6)7)40-34(49)50-22(3)4;1-11-15-23(27(43)30(45)36-19-25(42)38-26(31(46)40(9)10)22-16-13-12-14-17-22)37-29(44)24-18-35(7,8)20-41(24)32(47)28(34(4,5)6)39-33(48)49-21(2)3;1-5-12-25(30(42)32(44)36-19-27(41)38-29(34(46)47)24-15-10-7-11-16-24)37-31(43)26-18-17-22(4)40(26)33(45)28(23-13-8-6-9-14-23)39-35(48)49-20-21(2)3/h9,11-12,16-17,23,25-27,29-33H,7-8,10,13-15,18-22H2,1-6H3,(H,41,50)(H,42,49)(H,43,47)(H,44,54);5,7-9,12-13,15-16,19-20,25,27,29-31,33-34H,4,6,10-11,14,17-18,21-24H2,1-3H3,(H,41,49)(H,42,48)(H,43,46)(H,44,53)(H,51,52);10,12-13,17-18,24-25,27-29,31-32H,9,11,14-16,19-23H2,1-8H3,(H,40,49)(H,41,48)(H,42,46)(H,43,52);12-16,21-22,24-25,27,29H,17-20H2,1-11H3,(H,37,46)(H,38,45)(H,39,43)(H,40,49);12-14,16-17,21,23-24,26,28H,11,15,18-20H2,1-10H3,(H,36,45)(H,37,44)(H,38,42)(H,39,48);7,10-11,15-16,21-23,25-26,28-29H,5-6,8-9,12-14,17-20H2,1-4H3,(H,36,44)(H,37,43)(H,38,41)(H,39,48)(H,46,47)/t26-,27?,29+,30-,31?,32-,33-;29?,30-,31+,33+,34?;25-,28?,29?,31?,32+;24?,25-,27?,29+;23?,24-,26?,28+;22-,25?,26+,28+,29?/m011001/s1.
What are the key properties of 2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-methylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-phenylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;ethyl (1R,2S,5S,6S)-3-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-3-azabicyclo[3.1.0]hexane-6-carboxylate;[(2R)-3-methylbutan-2-yl] N-[(1S)-1-cyclohexyl-2-[2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-2-oxoethyl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-5-methyl-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate?
2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-methylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-phenylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;ethyl (1R,2S,5S,6S)-3-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-3-azabicyclo[3.1.0]hexane-6-carboxylate;[(2R)-3-methylbutan-2-yl] N-[(1S)-1-cyclohexyl-2-[2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-2-oxoethyl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-5-methyl-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate has a molecular weight of 4345.32 g/mol, XLogP of 16.09, 95 rotatable bonds, 26 hydrogen bond donors, and 50 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-methylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;2-[[2-[[3-[[(2S,5R)-1-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-5-phenylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid;ethyl (1R,2S,5S,6S)-3-[(2S)-2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-3-azabicyclo[3.1.0]hexane-6-carboxylate;[(2R)-3-methylbutan-2-yl] N-[(1S)-1-cyclohexyl-2-[2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-2-oxoethyl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate;propan-2-yl N-[(2S)-1-[(2S)-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-5-methyl-1,2-dioxohexan-3-yl]carbamoyl]-4,4-dimethylpyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate is sourced from PubChem (CID 157071249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).