(4S,7R)-4-[[1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(5S)-7-amino-5-[[5-[[5-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]amino]-4-oxopentanoyl]amino]-4-oxopentanoyl]amino]-4,7-dioxoheptanoyl]amino]-3-carboxypropanoyl]amino]-3-phenylpropanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-7-[[(2S)-1-[[(1S)-1-carboxy-3-methylbutyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl]-5-oxodecanedioic acid;(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-[(3S)-1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]pyrrolidine-2-carboxamide;3,3,3-trifluoropropanoic acid

C126H176ClF3N26O38 — CID 158515265

About (4S,7R)-4-[[1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(5S)-7-amino-5-[[5-[[5-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]amino]-4-oxopentanoyl]amino]-4-oxopentanoyl]amino]-4,7-dioxoheptanoyl]amino]-3-carboxypropanoyl]amino]-3-phenylpropanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-7-[[(2S)-1-[[(1S)-1-carboxy-3-methylbutyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl]-5-oxodecanedioic acid;(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-[(3S)-1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]pyrrolidine-2-carboxamide;3,3,3-trifluoropropanoic acid

(4S,7R)-4-[[1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(5S)-7-amino-5-[[5-[[5-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]amino]-4-oxopentanoyl]amino]-4-oxopentanoyl]amino]-4,7-dioxoheptanoyl]amino]-3-carboxypropanoyl]amino]-3-phenylpropanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-7-[[(2S)-1-[[(1S)-1-carboxy-3-methylbutyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl]-5-oxodecanedioic acid;(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-[(3S)-1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]pyrrolidine-2-carboxamide;3,3,3-trifluoropropanoic acid (PubChem CID 158515265) has the molecular formula C126H176ClF3N26O38 and a molecular weight of 2755.38 g/mol. Its IUPAC name is (4S,7R)-4-[[1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(5S)-7-amino-5-[[5-[[5-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]amino]-4-oxopentanoyl]amino]-4-oxopentanoyl]amino]-4,7-dioxoheptanoyl]amino]-3-carboxypropanoyl]amino]-3-phenylpropanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-7-[[(2S)-1-[[(1S)-1-carboxy-3-methylbutyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl]-5-oxodecanedioic acid;(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-[(3S)-1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]pyrrolidine-2-carboxamide;3,3,3-trifluoropropanoic acid.

Molecular Properties

• Compound Name: (4S,7R)-4-[[1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(5S)-7-amino-5-[[5-[[5-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]amino]-4-oxopentanoyl]amino]-4-oxopentanoyl]amino]-4,7-dioxoheptanoyl]amino]-3-carboxypropanoyl]amino]-3-phenylpropanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-7-[[(2S)-1-[[(1S)-1-carboxy-3-methylbutyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl]-5-oxodecanedioic acid;(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-[(3S)-1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]pyrrolidine-2-carboxamide;3,3,3-trifluoropropanoic acid
• PubChem CID: 158515265
• Molecular Formula: C126H176ClF3N26O38
• Molecular Weight: 2755.38 g/mol
• Exact Mass: 2753.23
• IUPAC Name: (4S,7R)-4-[[1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(5S)-7-amino-5-[[5-[[5-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]amino]-4-oxopentanoyl]amino]-4-oxopentanoyl]amino]-4,7-dioxoheptanoyl]amino]-3-carboxypropanoyl]amino]-3-phenylpropanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-7-[[(2S)-1-[[(1S)-1-carboxy-3-methylbutyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl]-5-oxodecanedioic acid;(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-[(3S)-1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]pyrrolidine-2-carboxamide;3,3,3-trifluoropropanoic acid
• SMILES: NC(N)=NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](N)Cc1ccccc1)C(=O)CCl.O=C(O)CC(F)(F)F.[H]/N=C(\N)NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](N)Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)NCC(=O)CCC(=O)NCC(=O)CCC(=O)N[C@@H](CC(N)=O)C(=O)CCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N1CCCC1C(=O)N[C@@H](CCC(=O)O)C(=O)C[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC
• InChI: InChI=1S/C102H142N20O33.C21H31ClN6O3.C3H3F3O2/c1-5-56(4)88(100(153)122-45-15-23-76(122)96(149)112-65(31-39-84(134)135)78(127)50-60(26-38-83(132)133)89(142)116-70(49-59-24-27-61(123)28-25-59)93(146)118-73(101(154)155)46-55(2)3)119-91(144)67(33-41-86(138)139)113-90(143)66(32-40-85(136)137)114-92(145)71(48-58-18-10-7-11-19-58)117-94(147)72(52-87(140)141)111-82(131)37-34-77(126)69(51-79(104)128)110-81(130)36-30-62(124)53-108-80(129)35-29-63(125)54-109-95(148)74-21-13-44-121(74)99(152)68(20-12-42-107-102(105)106)115-97(150)75-22-14-43-120(75)98(151)64(103)47-57-16-8-6-9-17-57;22-13-18(29)16(8-4-10-26-21(24)25)27-19(30)17-9-5-11-28(17)20(31)15(23)12-14-6-2-1-3-7-14;4-3(5,6)1-2(7)8/h6-11,16-19,24-25,27-28,55-56,60,64-76,88,123H,5,12-15,20-23,26,29-54,103H2,1-4H3,(H2,104,128)(H,108,129)(H,109,148)(H,110,130)(H,111,131)(H,112,149)(H,113,143)(H,114,145)(H,115,150)(H,116,142)(H,117,147)(H,118,146)(H,119,144)(H,132,133)(H,134,135)(H,136,137)(H,138,139)(H,140,141)(H,154,155)(H4,105,106,107);1-3,6-7,15-17H,4-5,8-13,23H2,(H,27,30)(H4,24,25,26);1H2,(H,7,8)/t56-,60+,64+,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76?,88-;15-,16+,17+;/m01./s1
• InChIKey: HLNZDLJSQDUCQY-PTYSVZGYSA-N
• XLogP: -2.41
• TPSA: 1047.65 Ų
• H-Bond Donors: 29
• H-Bond Acceptors: 35
• Rotatable Bonds: 82
• Heavy Atoms: 194
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2755.38
LogP ≤ 5	-2.41
H-Bond Donors ≤ 5	29
H-Bond Acceptors ≤ 10	35

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (4S,7R)-4-[[1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(5S)-7-amino-5-[[5-[[5-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]amino]-4-oxopentanoyl]amino]-4-oxopentanoyl]amino]-4,7-dioxoheptanoyl]amino]-3-carboxypropanoyl]amino]-3-phenylpropanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-7-[[(2S)-1-[[(1S)-1-carboxy-3-methylbutyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl]-5-oxodecanedioic acid;(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-[(3S)-1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]pyrrolidine-2-carboxamide;3,3,3-trifluoropropanoic acid?

The IUPAC name of (4S,7R)-4-[[1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(5S)-7-amino-5-[[5-[[5-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]amino]-4-oxopentanoyl]amino]-4-oxopentanoyl]amino]-4,7-dioxoheptanoyl]amino]-3-carboxypropanoyl]amino]-3-phenylpropanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-7-[[(2S)-1-[[(1S)-1-carboxy-3-methylbutyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl]-5-oxodecanedioic acid;(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-[(3S)-1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]pyrrolidine-2-carboxamide;3,3,3-trifluoropropanoic acid (CID 158515265) is (4S,7R)-4-[[1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(5S)-7-amino-5-[[5-[[5-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]amino]-4-oxopentanoyl]amino]-4-oxopentanoyl]amino]-4,7-dioxoheptanoyl]amino]-3-carboxypropanoyl]amino]-3-phenylpropanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-7-[[(2S)-1-[[(1S)-1-carboxy-3-methylbutyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl]-5-oxodecanedioic acid;(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-[(3S)-1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]pyrrolidine-2-carboxamide;3,3,3-trifluoropropanoic acid.

What is the SMILES notation for (4S,7R)-4-[[1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(5S)-7-amino-5-[[5-[[5-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]amino]-4-oxopentanoyl]amino]-4-oxopentanoyl]amino]-4,7-dioxoheptanoyl]amino]-3-carboxypropanoyl]amino]-3-phenylpropanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-7-[[(2S)-1-[[(1S)-1-carboxy-3-methylbutyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl]-5-oxodecanedioic acid;(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-[(3S)-1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]pyrrolidine-2-carboxamide;3,3,3-trifluoropropanoic acid?

The canonical SMILES for (4S,7R)-4-[[1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(5S)-7-amino-5-[[5-[[5-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]amino]-4-oxopentanoyl]amino]-4-oxopentanoyl]amino]-4,7-dioxoheptanoyl]amino]-3-carboxypropanoyl]amino]-3-phenylpropanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-7-[[(2S)-1-[[(1S)-1-carboxy-3-methylbutyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl]-5-oxodecanedioic acid;(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-[(3S)-1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]pyrrolidine-2-carboxamide;3,3,3-trifluoropropanoic acid is NC(N)=NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](N)Cc1ccccc1)C(=O)CCl.O=C(O)CC(F)(F)F.[H]/N=C(\N)NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](N)Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)NCC(=O)CCC(=O)NCC(=O)CCC(=O)N[C@@H](CC(N)=O)C(=O)CCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N1CCCC1C(=O)N[C@@H](CCC(=O)O)C(=O)C[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC.

What is the InChIKey of (4S,7R)-4-[[1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(5S)-7-amino-5-[[5-[[5-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]amino]-4-oxopentanoyl]amino]-4-oxopentanoyl]amino]-4,7-dioxoheptanoyl]amino]-3-carboxypropanoyl]amino]-3-phenylpropanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-7-[[(2S)-1-[[(1S)-1-carboxy-3-methylbutyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl]-5-oxodecanedioic acid;(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-[(3S)-1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]pyrrolidine-2-carboxamide;3,3,3-trifluoropropanoic acid?

The InChIKey is HLNZDLJSQDUCQY-PTYSVZGYSA-N. The full InChI is InChI=1S/C102H142N20O33.C21H31ClN6O3.C3H3F3O2/c1-5-56(4)88(100(153)122-45-15-23-76(122)96(149)112-65(31-39-84(134)135)78(127)50-60(26-38-83(132)133)89(142)116-70(49-59-24-27-61(123)28-25-59)93(146)118-73(101(154)155)46-55(2)3)119-91(144)67(33-41-86(138)139)113-90(143)66(32-40-85(136)137)114-92(145)71(48-58-18-10-7-11-19-58)117-94(147)72(52-87(140)141)111-82(131)37-34-77(126)69(51-79(104)128)110-81(130)36-30-62(124)53-108-80(129)35-29-63(125)54-109-95(148)74-21-13-44-121(74)99(152)68(20-12-42-107-102(105)106)115-97(150)75-22-14-43-120(75)98(151)64(103)47-57-16-8-6-9-17-57;22-13-18(29)16(8-4-10-26-21(24)25)27-19(30)17-9-5-11-28(17)20(31)15(23)12-14-6-2-1-3-7-14;4-3(5,6)1-2(7)8/h6-11,16-19,24-25,27-28,55-56,60,64-76,88,123H,5,12-15,20-23,26,29-54,103H2,1-4H3,(H2,104,128)(H,108,129)(H,109,148)(H,110,130)(H,111,131)(H,112,149)(H,113,143)(H,114,145)(H,115,150)(H,116,142)(H,117,147)(H,118,146)(H,119,144)(H,132,133)(H,134,135)(H,136,137)(H,138,139)(H,140,141)(H,154,155)(H4,105,106,107);1-3,6-7,15-17H,4-5,8-13,23H2,(H,27,30)(H4,24,25,26);1H2,(H,7,8)/t56-,60+,64+,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76?,88-;15-,16+,17+;/m01./s1.

What are the key properties of (4S,7R)-4-[[1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(5S)-7-amino-5-[[5-[[5-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]amino]-4-oxopentanoyl]amino]-4-oxopentanoyl]amino]-4,7-dioxoheptanoyl]amino]-3-carboxypropanoyl]amino]-3-phenylpropanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-7-[[(2S)-1-[[(1S)-1-carboxy-3-methylbutyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl]-5-oxodecanedioic acid;(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-[(3S)-1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]pyrrolidine-2-carboxamide;3,3,3-trifluoropropanoic acid?

(4S,7R)-4-[[1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(5S)-7-amino-5-[[5-[[5-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]amino]-4-oxopentanoyl]amino]-4-oxopentanoyl]amino]-4,7-dioxoheptanoyl]amino]-3-carboxypropanoyl]amino]-3-phenylpropanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-7-[[(2S)-1-[[(1S)-1-carboxy-3-methylbutyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl]-5-oxodecanedioic acid;(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-[(3S)-1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]pyrrolidine-2-carboxamide;3,3,3-trifluoropropanoic acid has a molecular weight of 2755.38 g/mol, XLogP of -2.41, 82 rotatable bonds, 29 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for (4S,7R)-4-[[1-[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(5S)-7-amino-5-[[5-[[5-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]amino]-4-oxopentanoyl]amino]-4-oxopentanoyl]amino]-4,7-dioxoheptanoyl]amino]-3-carboxypropanoyl]amino]-3-phenylpropanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-7-[[(2S)-1-[[(1S)-1-carboxy-3-methylbutyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl]-5-oxodecanedioic acid;(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-[(3S)-1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]pyrrolidine-2-carboxamide;3,3,3-trifluoropropanoic acid is sourced from PubChem (CID 158515265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).