(1S,4R,7Z,14S,18R)-14-[[(1S)-1-cyclobutyl-2-(1-oxo-3,4-dihydroisoquinolin-2-yl)ethyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-14-[[1-(cyclopropylsulfonylmethyl)cyclohexyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-14-[[(2S)-3-methyl-1-(2-oxopiperidin-1-yl)butan-2-yl]carbamoylamino]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid

C140H179N23O25S4 — CID 158148333

About (1S,4R,7Z,14S,18R)-14-[[(1S)-1-cyclobutyl-2-(1-oxo-3,4-dihydroisoquinolin-2-yl)ethyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-14-[[1-(cyclopropylsulfonylmethyl)cyclohexyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-14-[[(2S)-3-methyl-1-(2-oxopiperidin-1-yl)butan-2-yl]carbamoylamino]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid

(1S,4R,7Z,14S,18R)-14-[[(1S)-1-cyclobutyl-2-(1-oxo-3,4-dihydroisoquinolin-2-yl)ethyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-14-[[1-(cyclopropylsulfonylmethyl)cyclohexyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-14-[[(2S)-3-methyl-1-(2-oxopiperidin-1-yl)butan-2-yl]carbamoylamino]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid (PubChem CID 158148333) has the molecular formula C140H179N23O25S4 and a molecular weight of 2712.38 g/mol. Its IUPAC name is (1S,4R,7Z,14S,18R)-14-[[(1S)-1-cyclobutyl-2-(1-oxo-3,4-dihydroisoquinolin-2-yl)ethyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-14-[[1-(cyclopropylsulfonylmethyl)cyclohexyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-14-[[(2S)-3-methyl-1-(2-oxopiperidin-1-yl)butan-2-yl]carbamoylamino]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid.

Molecular Properties

• Compound Name: (1S,4R,7Z,14S,18R)-14-[[(1S)-1-cyclobutyl-2-(1-oxo-3,4-dihydroisoquinolin-2-yl)ethyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-14-[[1-(cyclopropylsulfonylmethyl)cyclohexyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-14-[[(2S)-3-methyl-1-(2-oxopiperidin-1-yl)butan-2-yl]carbamoylamino]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid
• PubChem CID: 158148333
• Molecular Formula: C140H179N23O25S4
• Molecular Weight: 2712.38 g/mol
• Exact Mass: 2710.23
• IUPAC Name: (1S,4R,7Z,14S,18R)-14-[[(1S)-1-cyclobutyl-2-(1-oxo-3,4-dihydroisoquinolin-2-yl)ethyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-14-[[1-(cyclopropylsulfonylmethyl)cyclohexyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-14-[[(2S)-3-methyl-1-(2-oxopiperidin-1-yl)butan-2-yl]carbamoylamino]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid
• SMILES: COc1ccc2c(O[C@@H]3C[C@H]4C(=O)N[C@]5(C(=O)O)CC5/C=C\CCCCC[C@H](NC(=O)NC5(CS(=O)(=O)C6CC6)CCCCC5)C(=O)N4C3)cc(-c3csc(NC(C)C)n3)nc2c1.COc1ccc2c(O[C@@H]3C[C@H]4C(=O)N[C@]5(C(=O)O)CC5/C=C\CCCCC[C@H](NC(=O)N[C@H](CN5CCCCC5=O)C(C)C)C(=O)N4C3)cc(-c3csc(NC(C)C)n3)nc2c1.COc1ccc2c(O[C@@H]3C[C@H]4C(=O)N[C@]5(C(=O)O)CC5/C=C\CCCCC[C@H](NC(=O)N[C@H](CN5CCc6ccccc6C5=O)C5CCC5)C(=O)N4C3)cc(-c3csc(NC(C)C)n3)nc2c1
• InChI: InChI=1S/C50H60N8O8S.C45H60N8O8S.C45H59N7O9S2/c1-29(2)51-49-55-41(28-67-49)39-24-43(36-19-18-33(65-3)22-38(36)52-39)66-34-23-42-44(59)56-50(47(62)63)25-32(50)15-7-5-4-6-8-17-37(46(61)58(42)26-34)53-48(64)54-40(31-13-11-14-31)27-57-21-20-30-12-9-10-16-35(30)45(57)60;1-26(2)35(24-52-18-12-11-15-39(52)54)49-43(59)48-32-14-10-8-6-7-9-13-28-22-45(28,42(57)58)51-40(55)37-20-30(23-53(37)41(32)56)61-38-21-34(36-25-62-44(50-36)46-27(3)4)47-33-19-29(60-5)16-17-31(33)38;1-27(2)46-43-49-36(25-62-43)35-22-38(32-17-14-29(60-3)20-34(32)47-35)61-30-21-37-39(53)50-45(41(55)56)23-28(45)12-8-5-4-6-9-13-33(40(54)52(37)24-30)48-42(57)51-44(18-10-7-11-19-44)26-63(58,59)31-15-16-31/h7,9-10,12,15-16,18-19,22,24,28-29,31-32,34,37,40,42H,4-6,8,11,13-14,17,20-21,23,25-27H2,1-3H3,(H,51,55)(H,56,59)(H,62,63)(H2,53,54,64);9,13,16-17,19,21,25-28,30,32,35,37H,6-8,10-12,14-15,18,20,22-24H2,1-5H3,(H,46,50)(H,51,55)(H,57,58)(H2,48,49,59);8,12,14,17,20,22,25,27-28,30-31,33,37H,4-7,9-11,13,15-16,18-19,21,23-24,26H2,1-3H3,(H,46,49)(H,50,53)(H,55,56)(H2,48,51,57)/b15-7-;13-9-;12-8-/t32?,34-,37+,40-,42+,50-;28?,30-,32+,35-,37+,45-;28?,30-,33+,37+,45-/m111/s1
• InChIKey: FUUDIGNCPIDWCB-KKPPEETDSA-N
• XLogP: 18.23
• TPSA: 627.09 Ų
• H-Bond Donors: 15
• H-Bond Acceptors: 34
• Rotatable Bonds: 36
• Heavy Atoms: 192
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2712.38
LogP ≤ 5	18.23
H-Bond Donors ≤ 5	15
H-Bond Acceptors ≤ 10	34

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (1S,4R,7Z,14S,18R)-14-[[(1S)-1-cyclobutyl-2-(1-oxo-3,4-dihydroisoquinolin-2-yl)ethyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-14-[[1-(cyclopropylsulfonylmethyl)cyclohexyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-14-[[(2S)-3-methyl-1-(2-oxopiperidin-1-yl)butan-2-yl]carbamoylamino]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid?

The IUPAC name of (1S,4R,7Z,14S,18R)-14-[[(1S)-1-cyclobutyl-2-(1-oxo-3,4-dihydroisoquinolin-2-yl)ethyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-14-[[1-(cyclopropylsulfonylmethyl)cyclohexyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-14-[[(2S)-3-methyl-1-(2-oxopiperidin-1-yl)butan-2-yl]carbamoylamino]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid (CID 158148333) is (1S,4R,7Z,14S,18R)-14-[[(1S)-1-cyclobutyl-2-(1-oxo-3,4-dihydroisoquinolin-2-yl)ethyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-14-[[1-(cyclopropylsulfonylmethyl)cyclohexyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-14-[[(2S)-3-methyl-1-(2-oxopiperidin-1-yl)butan-2-yl]carbamoylamino]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid.

What is the SMILES notation for (1S,4R,7Z,14S,18R)-14-[[(1S)-1-cyclobutyl-2-(1-oxo-3,4-dihydroisoquinolin-2-yl)ethyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-14-[[1-(cyclopropylsulfonylmethyl)cyclohexyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-14-[[(2S)-3-methyl-1-(2-oxopiperidin-1-yl)butan-2-yl]carbamoylamino]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid?

The canonical SMILES for (1S,4R,7Z,14S,18R)-14-[[(1S)-1-cyclobutyl-2-(1-oxo-3,4-dihydroisoquinolin-2-yl)ethyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-14-[[1-(cyclopropylsulfonylmethyl)cyclohexyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-14-[[(2S)-3-methyl-1-(2-oxopiperidin-1-yl)butan-2-yl]carbamoylamino]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid is COc1ccc2c(O[C@@H]3C[C@H]4C(=O)N[C@]5(C(=O)O)CC5/C=C\CCCCC[C@H](NC(=O)NC5(CS(=O)(=O)C6CC6)CCCCC5)C(=O)N4C3)cc(-c3csc(NC(C)C)n3)nc2c1.COc1ccc2c(O[C@@H]3C[C@H]4C(=O)N[C@]5(C(=O)O)CC5/C=C\CCCCC[C@H](NC(=O)N[C@H](CN5CCCCC5=O)C(C)C)C(=O)N4C3)cc(-c3csc(NC(C)C)n3)nc2c1.COc1ccc2c(O[C@@H]3C[C@H]4C(=O)N[C@]5(C(=O)O)CC5/C=C\CCCCC[C@H](NC(=O)N[C@H](CN5CCc6ccccc6C5=O)C5CCC5)C(=O)N4C3)cc(-c3csc(NC(C)C)n3)nc2c1.

What is the InChIKey of (1S,4R,7Z,14S,18R)-14-[[(1S)-1-cyclobutyl-2-(1-oxo-3,4-dihydroisoquinolin-2-yl)ethyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-14-[[1-(cyclopropylsulfonylmethyl)cyclohexyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-14-[[(2S)-3-methyl-1-(2-oxopiperidin-1-yl)butan-2-yl]carbamoylamino]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid?

The InChIKey is FUUDIGNCPIDWCB-KKPPEETDSA-N. The full InChI is InChI=1S/C50H60N8O8S.C45H60N8O8S.C45H59N7O9S2/c1-29(2)51-49-55-41(28-67-49)39-24-43(36-19-18-33(65-3)22-38(36)52-39)66-34-23-42-44(59)56-50(47(62)63)25-32(50)15-7-5-4-6-8-17-37(46(61)58(42)26-34)53-48(64)54-40(31-13-11-14-31)27-57-21-20-30-12-9-10-16-35(30)45(57)60;1-26(2)35(24-52-18-12-11-15-39(52)54)49-43(59)48-32-14-10-8-6-7-9-13-28-22-45(28,42(57)58)51-40(55)37-20-30(23-53(37)41(32)56)61-38-21-34(36-25-62-44(50-36)46-27(3)4)47-33-19-29(60-5)16-17-31(33)38;1-27(2)46-43-49-36(25-62-43)35-22-38(32-17-14-29(60-3)20-34(32)47-35)61-30-21-37-39(53)50-45(41(55)56)23-28(45)12-8-5-4-6-9-13-33(40(54)52(37)24-30)48-42(57)51-44(18-10-7-11-19-44)26-63(58,59)31-15-16-31/h7,9-10,12,15-16,18-19,22,24,28-29,31-32,34,37,40,42H,4-6,8,11,13-14,17,20-21,23,25-27H2,1-3H3,(H,51,55)(H,56,59)(H,62,63)(H2,53,54,64);9,13,16-17,19,21,25-28,30,32,35,37H,6-8,10-12,14-15,18,20,22-24H2,1-5H3,(H,46,50)(H,51,55)(H,57,58)(H2,48,49,59);8,12,14,17,20,22,25,27-28,30-31,33,37H,4-7,9-11,13,15-16,18-19,21,23-24,26H2,1-3H3,(H,46,49)(H,50,53)(H,55,56)(H2,48,51,57)/b15-7-;13-9-;12-8-/t32?,34-,37+,40-,42+,50-;28?,30-,32+,35-,37+,45-;28?,30-,33+,37+,45-/m111/s1.

What are the key properties of (1S,4R,7Z,14S,18R)-14-[[(1S)-1-cyclobutyl-2-(1-oxo-3,4-dihydroisoquinolin-2-yl)ethyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-14-[[1-(cyclopropylsulfonylmethyl)cyclohexyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-14-[[(2S)-3-methyl-1-(2-oxopiperidin-1-yl)butan-2-yl]carbamoylamino]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid?

(1S,4R,7Z,14S,18R)-14-[[(1S)-1-cyclobutyl-2-(1-oxo-3,4-dihydroisoquinolin-2-yl)ethyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-14-[[1-(cyclopropylsulfonylmethyl)cyclohexyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-14-[[(2S)-3-methyl-1-(2-oxopiperidin-1-yl)butan-2-yl]carbamoylamino]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid has a molecular weight of 2712.38 g/mol, XLogP of 18.23, 36 rotatable bonds, 15 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for (1S,4R,7Z,14S,18R)-14-[[(1S)-1-cyclobutyl-2-(1-oxo-3,4-dihydroisoquinolin-2-yl)ethyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-14-[[1-(cyclopropylsulfonylmethyl)cyclohexyl]carbamoylamino]-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid;(1S,4R,7Z,14S,18R)-18-[7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-14-[[(2S)-3-methyl-1-(2-oxopiperidin-1-yl)butan-2-yl]carbamoylamino]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid is sourced from PubChem (CID 158148333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).