1-chloro-2-[chloro-(4-methylphenyl)-phenylmethyl]benzene;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-amino-4-methylpentanoate;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoate;(2S)-4-methyl-2-[[(2R,5S)-5-[[(2R,5S)-5-[[(2R)-2-methyl-4-oxopentanoyl]amino]-7-[(2-methylpropan-2-yl)oxy]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4,7-dioxoheptanoyl]amino]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4-oxoheptanoyl]amino]pentanoic acid

C131H155Cl4N5O20 — CID 163578883

IUPAC1-chloro-2-[chloro-(4-methylphenyl)-phenylmethyl]benzene;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-amino-4-methylpentanoate;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoate;(2S)-4-methyl-2-[[(2R,5S)-5-[[(2R,5S)-5-[[(2R)-2-methyl-4-oxopentanoyl]amino]-7-[(2-methylpropan-2-yl)oxy]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4,7-dioxoheptanoyl]amino]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4-oxoheptanoyl]amino]pentanoic acid
SMILESCC[C@H](NC(=O)[C@H](CCC(=O)OC(C)(C)C)CC(=O)[C@H](CC(=O)OC(C)(C)C)NC(=O)[C@H](C)CC(C)=O)C(=O)C[C@@H](CCC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O.Cc1ccc(C(Cl)(c2ccccc2)c2ccccc2Cl)cc1.Cc1ccc(C(OC(=O)[C@@H](N)CC(C)C)(c2ccccc2)c2ccccc2Cl)cc1.Cc1ccc(C(OC(=O)[C@H](CC(C)C)NC(=O)OCC2c3ccccc3-c3ccccc32)(c2ccccc2)c2ccccc2Cl)cc1
InChIInChI=1S/C44H73N3O14.C41H38ClNO4.C26H28ClNO2.C20H16Cl2/c1-15-30(33(49)22-28(16-18-35(51)59-42(6,7)8)40(56)47-32(41(57)58)20-25(2)3)45-39(55)29(17-19-36(52)60-43(9,10)11)23-34(50)31(24-37(53)61-44(12,13)14)46-38(54)26(4)21-27(5)48;1-27(2)25-38(43-40(45)46-26-35-33-17-9-7-15-31(33)32-16-8-10-18-34(32)35)39(44)47-41(29-13-5-4-6-14-29,30-23-21-28(3)22-24-30)36-19-11-12-20-37(36)42;1-18(2)17-24(28)25(29)30-26(20-9-5-4-6-10-20,21-15-13-19(3)14-16-21)22-11-7-8-12-23(22)27;1-15-11-13-17(14-12-15)20(22,16-7-3-2-4-8-16)18-9-5-6-10-19(18)21/h25-26,28-32H,15-24H2,1-14H3,(H,45,55)(H,46,54)(H,47,56)(H,57,58);4-24,27,35,38H,25-26H2,1-3H3,(H,43,45);4-16,18,24H,17,28H2,1-3H3;2-14H,1H3/t26-,28-,29-,30+,31+,32+;38-,41?;24-,26?;/m100./s1
InChIKeyGFVWVCPGIQXISO-GYJVNSFLSA-N
MW2261.51 g/mol
LogP26.20
Rot. Bonds46

About 1-chloro-2-[chloro-(4-methylphenyl)-phenylmethyl]benzene;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-amino-4-methylpentanoate;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoate;(2S)-4-methyl-2-[[(2R,5S)-5-[[(2R,5S)-5-[[(2R)-2-methyl-4-oxopentanoyl]amino]-7-[(2-methylpropan-2-yl)oxy]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4,7-dioxoheptanoyl]amino]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4-oxoheptanoyl]amino]pentanoic acid

1-chloro-2-[chloro-(4-methylphenyl)-phenylmethyl]benzene;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-amino-4-methylpentanoate;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoate;(2S)-4-methyl-2-[[(2R,5S)-5-[[(2R,5S)-5-[[(2R)-2-methyl-4-oxopentanoyl]amino]-7-[(2-methylpropan-2-yl)oxy]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4,7-dioxoheptanoyl]amino]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4-oxoheptanoyl]amino]pentanoic acid (PubChem CID 163578883) has the molecular formula C131H155Cl4N5O20 and a molecular weight of 2261.51 g/mol. Its IUPAC name is 1-chloro-2-[chloro-(4-methylphenyl)-phenylmethyl]benzene;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-amino-4-methylpentanoate;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoate;(2S)-4-methyl-2-[[(2R,5S)-5-[[(2R,5S)-5-[[(2R)-2-methyl-4-oxopentanoyl]amino]-7-[(2-methylpropan-2-yl)oxy]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4,7-dioxoheptanoyl]amino]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4-oxoheptanoyl]amino]pentanoic acid.

Molecular Properties

Compound Name1-chloro-2-[chloro-(4-methylphenyl)-phenylmethyl]benzene;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-amino-4-methylpentanoate;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoate;(2S)-4-methyl-2-[[(2R,5S)-5-[[(2R,5S)-5-[[(2R)-2-methyl-4-oxopentanoyl]amino]-7-[(2-methylpropan-2-yl)oxy]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4,7-dioxoheptanoyl]amino]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4-oxoheptanoyl]amino]pentanoic acid
PubChem CID163578883
Molecular FormulaC131H155Cl4N5O20
Molecular Weight2261.51 g/mol
Exact Mass2258.00
IUPAC Name1-chloro-2-[chloro-(4-methylphenyl)-phenylmethyl]benzene;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-amino-4-methylpentanoate;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoate;(2S)-4-methyl-2-[[(2R,5S)-5-[[(2R,5S)-5-[[(2R)-2-methyl-4-oxopentanoyl]amino]-7-[(2-methylpropan-2-yl)oxy]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4,7-dioxoheptanoyl]amino]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4-oxoheptanoyl]amino]pentanoic acid
SMILESCC[C@H](NC(=O)[C@H](CCC(=O)OC(C)(C)C)CC(=O)[C@H](CC(=O)OC(C)(C)C)NC(=O)[C@H](C)CC(C)=O)C(=O)C[C@@H](CCC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O.Cc1ccc(C(Cl)(c2ccccc2)c2ccccc2Cl)cc1.Cc1ccc(C(OC(=O)[C@@H](N)CC(C)C)(c2ccccc2)c2ccccc2Cl)cc1.Cc1ccc(C(OC(=O)[C@H](CC(C)C)NC(=O)OCC2c3ccccc3-c3ccccc32)(c2ccccc2)c2ccccc2Cl)cc1
InChIInChI=1S/C44H73N3O14.C41H38ClNO4.C26H28ClNO2.C20H16Cl2/c1-15-30(33(49)22-28(16-18-35(51)59-42(6,7)8)40(56)47-32(41(57)58)20-25(2)3)45-39(55)29(17-19-36(52)60-43(9,10)11)23-34(50)31(24-37(53)61-44(12,13)14)46-38(54)26(4)21-27(5)48;1-27(2)25-38(43-40(45)46-26-35-33-17-9-7-15-31(33)32-16-8-10-18-34(32)35)39(44)47-41(29-13-5-4-6-14-29,30-23-21-28(3)22-24-30)36-19-11-12-20-37(36)42;1-18(2)17-24(28)25(29)30-26(20-9-5-4-6-10-20,21-15-13-19(3)14-16-21)22-11-7-8-12-23(22)27;1-15-11-13-17(14-12-15)20(22,16-7-3-2-4-8-16)18-9-5-6-10-19(18)21/h25-26,28-32H,15-24H2,1-14H3,(H,45,55)(H,46,54)(H,47,56)(H,57,58);4-24,27,35,38H,25-26H2,1-3H3,(H,43,45);4-16,18,24H,17,28H2,1-3H3;2-14H,1H3/t26-,28-,29-,30+,31+,32+;38-,41?;24-,26?;/m100./s1
InChIKeyGFVWVCPGIQXISO-GYJVNSFLSA-N
XLogP26.20
TPSA371.66 Ų
H-Bond Donors6
H-Bond Acceptors20
Rotatable Bonds46
Heavy Atoms160
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002261.51
LogP ≤ 526.20
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze 1-chloro-2-[chloro-(4-methylphenyl)-phenylmethyl]benzene;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-amino-4-methylpentanoate;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoate;(2S)-4-methyl-2-[[(2R,5S)-5-[[(2R,5S)-5-[[(2R)-2-methyl-4-oxopentanoyl]amino]-7-[(2-methylpropan-2-yl)oxy]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4,7-dioxoheptanoyl]amino]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4-oxoheptanoyl]amino]pentanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-O-tert-butyl 5-O-[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)pentanedioate
CID 176765633
tert-butyl (2S)-2-amino-4-methylpentanoate;tert-butyl 2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylpentanoate;[4-[chloro-(2-chlorophenyl)-phenylmethyl]phenyl]phosphane;2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-hydroxyphenyl)propanoic acid;methane
CID 158729959
[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[(2-methylpropan-2-yl)oxy]propanoate
CID 51341278
[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (3S)-4-(dimethylamino)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxobutanoate
CID 168737538
[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-(3-methylbutoxy)butanoate
CID 168737519
21-O-tert-butyl 1-O-[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2R)-2-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethyl]-4-oxohenicosanedioate
CID 158822158
1-O-tert-butyl 5-O-[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] 2-aminopentanedioate;phosphane
CID 162076373
[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-2-hydroxypentanoate
CID 59963061
[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] 3-(9H-fluoren-9-ylmethoxycarbonylamino)propanoate
CID 168737401
(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoyl]amino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoyl]amino]-3-methylbutanoyl]amino]-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoic acid
CID 59247920
tert-butyl 4-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoyl]amino]-5-oxo-5-(propan-2-ylamino)pentanoate
CID 138631470
[(2-chlorophenyl)-diphenylmethyl] (3S)-4-(4-tert-butylpiperidin-1-yl)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxobutanoate
CID 175256760

Frequently Asked Questions

What is the IUPAC name of 1-chloro-2-[chloro-(4-methylphenyl)-phenylmethyl]benzene;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-amino-4-methylpentanoate;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoate;(2S)-4-methyl-2-[[(2R,5S)-5-[[(2R,5S)-5-[[(2R)-2-methyl-4-oxopentanoyl]amino]-7-[(2-methylpropan-2-yl)oxy]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4,7-dioxoheptanoyl]amino]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4-oxoheptanoyl]amino]pentanoic acid?
The IUPAC name of 1-chloro-2-[chloro-(4-methylphenyl)-phenylmethyl]benzene;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-amino-4-methylpentanoate;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoate;(2S)-4-methyl-2-[[(2R,5S)-5-[[(2R,5S)-5-[[(2R)-2-methyl-4-oxopentanoyl]amino]-7-[(2-methylpropan-2-yl)oxy]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4,7-dioxoheptanoyl]amino]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4-oxoheptanoyl]amino]pentanoic acid (CID 163578883) is 1-chloro-2-[chloro-(4-methylphenyl)-phenylmethyl]benzene;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-amino-4-methylpentanoate;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoate;(2S)-4-methyl-2-[[(2R,5S)-5-[[(2R,5S)-5-[[(2R)-2-methyl-4-oxopentanoyl]amino]-7-[(2-methylpropan-2-yl)oxy]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4,7-dioxoheptanoyl]amino]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4-oxoheptanoyl]amino]pentanoic acid.
What is the SMILES notation for 1-chloro-2-[chloro-(4-methylphenyl)-phenylmethyl]benzene;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-amino-4-methylpentanoate;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoate;(2S)-4-methyl-2-[[(2R,5S)-5-[[(2R,5S)-5-[[(2R)-2-methyl-4-oxopentanoyl]amino]-7-[(2-methylpropan-2-yl)oxy]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4,7-dioxoheptanoyl]amino]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4-oxoheptanoyl]amino]pentanoic acid?
The canonical SMILES for 1-chloro-2-[chloro-(4-methylphenyl)-phenylmethyl]benzene;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-amino-4-methylpentanoate;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoate;(2S)-4-methyl-2-[[(2R,5S)-5-[[(2R,5S)-5-[[(2R)-2-methyl-4-oxopentanoyl]amino]-7-[(2-methylpropan-2-yl)oxy]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4,7-dioxoheptanoyl]amino]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4-oxoheptanoyl]amino]pentanoic acid is CC[C@H](NC(=O)[C@H](CCC(=O)OC(C)(C)C)CC(=O)[C@H](CC(=O)OC(C)(C)C)NC(=O)[C@H](C)CC(C)=O)C(=O)C[C@@H](CCC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O.Cc1ccc(C(Cl)(c2ccccc2)c2ccccc2Cl)cc1.Cc1ccc(C(OC(=O)[C@@H](N)CC(C)C)(c2ccccc2)c2ccccc2Cl)cc1.Cc1ccc(C(OC(=O)[C@H](CC(C)C)NC(=O)OCC2c3ccccc3-c3ccccc32)(c2ccccc2)c2ccccc2Cl)cc1.
What is the InChIKey of 1-chloro-2-[chloro-(4-methylphenyl)-phenylmethyl]benzene;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-amino-4-methylpentanoate;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoate;(2S)-4-methyl-2-[[(2R,5S)-5-[[(2R,5S)-5-[[(2R)-2-methyl-4-oxopentanoyl]amino]-7-[(2-methylpropan-2-yl)oxy]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4,7-dioxoheptanoyl]amino]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4-oxoheptanoyl]amino]pentanoic acid?
The InChIKey is GFVWVCPGIQXISO-GYJVNSFLSA-N. The full InChI is InChI=1S/C44H73N3O14.C41H38ClNO4.C26H28ClNO2.C20H16Cl2/c1-15-30(33(49)22-28(16-18-35(51)59-42(6,7)8)40(56)47-32(41(57)58)20-25(2)3)45-39(55)29(17-19-36(52)60-43(9,10)11)23-34(50)31(24-37(53)61-44(12,13)14)46-38(54)26(4)21-27(5)48;1-27(2)25-38(43-40(45)46-26-35-33-17-9-7-15-31(33)32-16-8-10-18-34(32)35)39(44)47-41(29-13-5-4-6-14-29,30-23-21-28(3)22-24-30)36-19-11-12-20-37(36)42;1-18(2)17-24(28)25(29)30-26(20-9-5-4-6-10-20,21-15-13-19(3)14-16-21)22-11-7-8-12-23(22)27;1-15-11-13-17(14-12-15)20(22,16-7-3-2-4-8-16)18-9-5-6-10-19(18)21/h25-26,28-32H,15-24H2,1-14H3,(H,45,55)(H,46,54)(H,47,56)(H,57,58);4-24,27,35,38H,25-26H2,1-3H3,(H,43,45);4-16,18,24H,17,28H2,1-3H3;2-14H,1H3/t26-,28-,29-,30+,31+,32+;38-,41?;24-,26?;/m100./s1.
What are the key properties of 1-chloro-2-[chloro-(4-methylphenyl)-phenylmethyl]benzene;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-amino-4-methylpentanoate;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoate;(2S)-4-methyl-2-[[(2R,5S)-5-[[(2R,5S)-5-[[(2R)-2-methyl-4-oxopentanoyl]amino]-7-[(2-methylpropan-2-yl)oxy]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4,7-dioxoheptanoyl]amino]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4-oxoheptanoyl]amino]pentanoic acid?
1-chloro-2-[chloro-(4-methylphenyl)-phenylmethyl]benzene;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-amino-4-methylpentanoate;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoate;(2S)-4-methyl-2-[[(2R,5S)-5-[[(2R,5S)-5-[[(2R)-2-methyl-4-oxopentanoyl]amino]-7-[(2-methylpropan-2-yl)oxy]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4,7-dioxoheptanoyl]amino]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4-oxoheptanoyl]amino]pentanoic acid has a molecular weight of 2261.51 g/mol, XLogP of 26.20, 46 rotatable bonds, 6 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-2-[chloro-(4-methylphenyl)-phenylmethyl]benzene;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-amino-4-methylpentanoate;[(2-chlorophenyl)-(4-methylphenyl)-phenylmethyl] (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoate;(2S)-4-methyl-2-[[(2R,5S)-5-[[(2R,5S)-5-[[(2R)-2-methyl-4-oxopentanoyl]amino]-7-[(2-methylpropan-2-yl)oxy]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4,7-dioxoheptanoyl]amino]-2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4-oxoheptanoyl]amino]pentanoic acid is sourced from PubChem (CID 163578883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).