4-O-butyl 1-O-methyl 2-[(R)-[(3-amino-3H-indole-2-carbonyl)amino]-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-1H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-methoxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-oxo-1,2-dihydroindole-2-carbonyl)amino]methyl]butanedioate

C156H183N31O39 — CID 163607029

About 4-O-butyl 1-O-methyl 2-[(R)-[(3-amino-3H-indole-2-carbonyl)amino]-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-1H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-methoxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-oxo-1,2-dihydroindole-2-carbonyl)amino]methyl]butanedioate

4-O-butyl 1-O-methyl 2-[(R)-[(3-amino-3H-indole-2-carbonyl)amino]-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-1H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-methoxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-oxo-1,2-dihydroindole-2-carbonyl)amino]methyl]butanedioate (PubChem CID 163607029) has the molecular formula C156H183N31O39 and a molecular weight of 3116.36 g/mol. Its IUPAC name is 4-O-butyl 1-O-methyl 2-[(R)-[(3-amino-3H-indole-2-carbonyl)amino]-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-1H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-methoxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-oxo-1,2-dihydroindole-2-carbonyl)amino]methyl]butanedioate.

Molecular Properties

• Compound Name: 4-O-butyl 1-O-methyl 2-[(R)-[(3-amino-3H-indole-2-carbonyl)amino]-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-1H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-methoxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-oxo-1,2-dihydroindole-2-carbonyl)amino]methyl]butanedioate
• PubChem CID: 163607029
• Molecular Formula: C156H183N31O39
• Molecular Weight: 3116.36 g/mol
• Exact Mass: 3114.33
• IUPAC Name: 4-O-butyl 1-O-methyl 2-[(R)-[(3-amino-3H-indole-2-carbonyl)amino]-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-1H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-methoxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-oxo-1,2-dihydroindole-2-carbonyl)amino]methyl]butanedioate
• SMILES: [H]/N=C(\N)c1ccc(C2=NOC(CC(=O)N[C@H](NC(=O)C3=Nc4ccccc4C3N)C(CC(=O)OCCCC)C(=O)OC)C2)cc1.[H]/N=C(\N)c1ccc(C2=NOC(CC(=O)N[C@H](NC(=O)C3=Nc4ccccc4C3O)C(CC(=O)OCCCC)C(=O)OC)C2)cc1.[H]/N=C(\N)c1ccc(C2=NOC(CC(=O)N[C@H](NC(=O)C3=Nc4ccccc4C3OC)C(CC(=O)OCCCC)C(=O)OC)C2)cc1.[H]/N=C(\N)c1ccc(C2=NOC(CC(=O)N[C@H](NC(=O)C3Nc4ccccc4C3=O)C(CC(=O)OCCCC)C(=O)OC)C2)cc1.[H]/N=C(\N)c1ccc(C2=NOC(CC(=O)N[C@H](NC(=O)c3[nH]c4ccccc4c3O)C(CC(=O)OCCCC)C(=O)OC)C2)cc1
• InChI: InChI=1S/C32H38N6O8.C31H37N7O7.3C31H36N6O8/c1-4-5-14-45-26(40)17-22(32(42)44-3)30(37-31(41)27-28(43-2)21-8-6-7-9-23(21)35-27)36-25(39)16-20-15-24(38-46-20)18-10-12-19(13-11-18)29(33)34;1-3-4-13-44-25(40)16-21(31(42)43-2)29(37-30(41)27-26(32)20-7-5-6-8-22(20)35-27)36-24(39)15-19-14-23(38-45-19)17-9-11-18(12-10-17)28(33)34;3*1-3-4-13-44-25(39)16-21(31(42)43-2)29(36-30(41)26-27(40)20-7-5-6-8-22(20)34-26)35-24(38)15-19-14-23(37-45-19)17-9-11-18(12-10-17)28(32)33/h6-13,20,22,28,30H,4-5,14-17H2,1-3H3,(H3,33,34)(H,36,39)(H,37,41);5-12,19,21,26,29H,3-4,13-16,32H2,1-2H3,(H3,33,34)(H,36,39)(H,37,41);5-12,19,21,29,34,40H,3-4,13-16H2,1-2H3,(H3,32,33)(H,35,38)(H,36,41);5-12,19,21,27,29,40H,3-4,13-16H2,1-2H3,(H3,32,33)(H,35,38)(H,36,41);5-12,19,21,26,29,34H,3-4,13-16H2,1-2H3,(H3,32,33)(H,35,38)(H,36,41)/t20?,22?,28?,30-;19?,21?,26?,29-;19?,21?,29-;19?,21?,27?,29-;19?,21?,26?,29-/m11111/s1
• InChIKey: HCQYVTBWMNJDKD-VIDNRAGYSA-N
• XLogP: 9.93
• TPSA: 1068.98 Ų
• H-Bond Donors: 25
• H-Bond Acceptors: 54
• Rotatable Bonds: 71
• Heavy Atoms: 226
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3116.36
LogP ≤ 5	9.93
H-Bond Donors ≤ 5	25
H-Bond Acceptors ≤ 10	54

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-O-butyl 1-O-methyl 2-[(R)-[(3-amino-3H-indole-2-carbonyl)amino]-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-1H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-methoxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-oxo-1,2-dihydroindole-2-carbonyl)amino]methyl]butanedioate?

The IUPAC name of 4-O-butyl 1-O-methyl 2-[(R)-[(3-amino-3H-indole-2-carbonyl)amino]-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-1H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-methoxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-oxo-1,2-dihydroindole-2-carbonyl)amino]methyl]butanedioate (CID 163607029) is 4-O-butyl 1-O-methyl 2-[(R)-[(3-amino-3H-indole-2-carbonyl)amino]-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-1H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-methoxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-oxo-1,2-dihydroindole-2-carbonyl)amino]methyl]butanedioate.

What is the SMILES notation for 4-O-butyl 1-O-methyl 2-[(R)-[(3-amino-3H-indole-2-carbonyl)amino]-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-1H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-methoxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-oxo-1,2-dihydroindole-2-carbonyl)amino]methyl]butanedioate?

The canonical SMILES for 4-O-butyl 1-O-methyl 2-[(R)-[(3-amino-3H-indole-2-carbonyl)amino]-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-1H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-methoxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-oxo-1,2-dihydroindole-2-carbonyl)amino]methyl]butanedioate is [H]/N=C(\N)c1ccc(C2=NOC(CC(=O)N[C@H](NC(=O)C3=Nc4ccccc4C3N)C(CC(=O)OCCCC)C(=O)OC)C2)cc1.[H]/N=C(\N)c1ccc(C2=NOC(CC(=O)N[C@H](NC(=O)C3=Nc4ccccc4C3O)C(CC(=O)OCCCC)C(=O)OC)C2)cc1.[H]/N=C(\N)c1ccc(C2=NOC(CC(=O)N[C@H](NC(=O)C3=Nc4ccccc4C3OC)C(CC(=O)OCCCC)C(=O)OC)C2)cc1.[H]/N=C(\N)c1ccc(C2=NOC(CC(=O)N[C@H](NC(=O)C3Nc4ccccc4C3=O)C(CC(=O)OCCCC)C(=O)OC)C2)cc1.[H]/N=C(\N)c1ccc(C2=NOC(CC(=O)N[C@H](NC(=O)c3[nH]c4ccccc4c3O)C(CC(=O)OCCCC)C(=O)OC)C2)cc1.

What is the InChIKey of 4-O-butyl 1-O-methyl 2-[(R)-[(3-amino-3H-indole-2-carbonyl)amino]-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-1H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-methoxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-oxo-1,2-dihydroindole-2-carbonyl)amino]methyl]butanedioate?

The InChIKey is HCQYVTBWMNJDKD-VIDNRAGYSA-N. The full InChI is InChI=1S/C32H38N6O8.C31H37N7O7.3C31H36N6O8/c1-4-5-14-45-26(40)17-22(32(42)44-3)30(37-31(41)27-28(43-2)21-8-6-7-9-23(21)35-27)36-25(39)16-20-15-24(38-46-20)18-10-12-19(13-11-18)29(33)34;1-3-4-13-44-25(40)16-21(31(42)43-2)29(37-30(41)27-26(32)20-7-5-6-8-22(20)35-27)36-24(39)15-19-14-23(38-45-19)17-9-11-18(12-10-17)28(33)34;3*1-3-4-13-44-25(39)16-21(31(42)43-2)29(36-30(41)26-27(40)20-7-5-6-8-22(20)34-26)35-24(38)15-19-14-23(37-45-19)17-9-11-18(12-10-17)28(32)33/h6-13,20,22,28,30H,4-5,14-17H2,1-3H3,(H3,33,34)(H,36,39)(H,37,41);5-12,19,21,26,29H,3-4,13-16,32H2,1-2H3,(H3,33,34)(H,36,39)(H,37,41);5-12,19,21,29,34,40H,3-4,13-16H2,1-2H3,(H3,32,33)(H,35,38)(H,36,41);5-12,19,21,27,29,40H,3-4,13-16H2,1-2H3,(H3,32,33)(H,35,38)(H,36,41);5-12,19,21,26,29,34H,3-4,13-16H2,1-2H3,(H3,32,33)(H,35,38)(H,36,41)/t20?,22?,28?,30-;19?,21?,26?,29-;19?,21?,29-;19?,21?,27?,29-;19?,21?,26?,29-/m11111/s1.

What are the key properties of 4-O-butyl 1-O-methyl 2-[(R)-[(3-amino-3H-indole-2-carbonyl)amino]-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-1H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-methoxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-oxo-1,2-dihydroindole-2-carbonyl)amino]methyl]butanedioate?

4-O-butyl 1-O-methyl 2-[(R)-[(3-amino-3H-indole-2-carbonyl)amino]-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-1H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-methoxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-oxo-1,2-dihydroindole-2-carbonyl)amino]methyl]butanedioate has a molecular weight of 3116.36 g/mol, XLogP of 9.93, 71 rotatable bonds, 25 hydrogen bond donors, and 54 hydrogen bond acceptors.

Where does this data come from?

All data for 4-O-butyl 1-O-methyl 2-[(R)-[(3-amino-3H-indole-2-carbonyl)amino]-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-1H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-hydroxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-methoxy-3H-indole-2-carbonyl)amino]methyl]butanedioate;4-O-butyl 1-O-methyl 2-[(R)-[[2-[3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]-[(3-oxo-1,2-dihydroindole-2-carbonyl)amino]methyl]butanedioate is sourced from PubChem (CID 163607029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).