(2S)-2-[[4-[2-(2,4-diamino-5-chloroquinazolin-6-yl)ethyl]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[4-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[5-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methyl-methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid

C144H147Cl3N56O20S3 — CID 165054866

About (2S)-2-[[4-[2-(2,4-diamino-5-chloroquinazolin-6-yl)ethyl]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[4-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[5-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methyl-methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid

(2S)-2-[[4-[2-(2,4-diamino-5-chloroquinazolin-6-yl)ethyl]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[4-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[5-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methyl-methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid (PubChem CID 165054866) has the molecular formula C144H147Cl3N56O20S3 and a molecular weight of 3184.69 g/mol. Its IUPAC name is (2S)-2-[[4-[2-(2,4-diamino-5-chloroquinazolin-6-yl)ethyl]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[4-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[5-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methyl-methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid.

Molecular Properties

• Compound Name: (2S)-2-[[4-[2-(2,4-diamino-5-chloroquinazolin-6-yl)ethyl]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[4-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[5-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methyl-methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid
• PubChem CID: 165054866
• Molecular Formula: C144H147Cl3N56O20S3
• Molecular Weight: 3184.69 g/mol
• Exact Mass: 3181.04
• IUPAC Name: (2S)-2-[[4-[2-(2,4-diamino-5-chloroquinazolin-6-yl)ethyl]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[4-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[5-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methyl-methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid
• SMILES: Cc1ccc(C(=O)CCCC[C@H](NC(=O)c2ccc(CCc3ccc4nc(N)nc(N)c4c3Cl)cc2)C(=O)O)c(-c2nn[nH]n2)c1.Cc1ccc(C(=O)CCCC[C@H](NC(=O)c2ccc(NCc3ccc4nc(N)nc(N)c4c3Cl)cc2)C(=O)O)c(-c2nn[nH]n2)c1.Cc1ccc(C(=O)NCCC[C@H](NC(=O)c2ccc(N(C)Cc3cnc4nc(N)nc(N)c4n3)s2)C(=O)O)c(-c2nn[nH]n2)c1.Cc1ccc(C(=O)NCCC[C@H](NC(=O)c2ccc(NCc3ccc4nc(N)nc(N)c4c3Cl)s2)C(=O)O)c(-c2nn[nH]n2)c1.Cc1ccc(C(=O)NCCC[C@H](NC(=O)c2ccc(NCc3cnc4nc(N)nc(N)c4n3)s2)C(=O)O)c(-c2nn[nH]n2)c1
• InChI: InChI=1S/C32H32ClN9O4.C31H31ClN10O4.C28H28ClN11O4S.C27H29N13O4S.C26H27N13O4S/c1-17-6-14-21(22(16-17)29-39-41-42-40-29)25(43)5-3-2-4-24(31(45)46)36-30(44)20-11-8-18(9-12-20)7-10-19-13-15-23-26(27(19)33)28(34)38-32(35)37-23;1-16-6-12-20(21(14-16)28-39-41-42-40-28)24(43)5-3-2-4-23(30(45)46)36-29(44)17-7-10-19(11-8-17)35-15-18-9-13-22-25(26(18)32)27(33)38-31(34)37-22;1-13-4-6-15(16(11-13)24-37-39-40-38-24)25(41)32-10-2-3-18(27(43)44)34-26(42)19-8-9-20(45-19)33-12-14-5-7-17-21(22(14)29)23(30)36-28(31)35-17;1-13-5-6-15(16(10-13)22-36-38-39-37-22)24(41)30-9-3-4-17(26(43)44)33-25(42)18-7-8-19(45-18)40(2)12-14-11-31-23-20(32-14)21(28)34-27(29)35-23;1-12-4-5-14(15(9-12)21-36-38-39-37-21)23(40)29-8-2-3-16(25(42)43)33-24(41)17-6-7-18(44-17)30-10-13-11-31-22-19(32-13)20(27)34-26(28)35-22/h6,8-9,11-16,24H,2-5,7,10H2,1H3,(H,36,44)(H,45,46)(H4,34,35,37,38)(H,39,40,41,42);6-14,23,35H,2-5,15H2,1H3,(H,36,44)(H,45,46)(H4,33,34,37,38)(H,39,40,41,42);4-9,11,18,33H,2-3,10,12H2,1H3,(H,32,41)(H,34,42)(H,43,44)(H4,30,31,35,36)(H,37,38,39,40);5-8,10-11,17H,3-4,9,12H2,1-2H3,(H,30,41)(H,33,42)(H,43,44)(H,36,37,38,39)(H4,28,29,31,34,35);4-7,9,11,16,30H,2-3,8,10H2,1H3,(H,29,40)(H,33,41)(H,42,43)(H,36,37,38,39)(H4,27,28,31,34,35)/t24-;23-;18-;17-;16-/m00000/s1
• InChIKey: QGAQRYBEDIDMEC-JSJWZPOKSA-N
• XLogP: 13.83
• TPSA: 1205.73 Ų
• H-Bond Donors: 31
• H-Bond Acceptors: 61
• Rotatable Bonds: 62
• Heavy Atoms: 226
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3184.69
LogP ≤ 5	13.83
H-Bond Donors ≤ 5	31
H-Bond Acceptors ≤ 10	61

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[[4-[2-(2,4-diamino-5-chloroquinazolin-6-yl)ethyl]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[4-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[5-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methyl-methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid?

The IUPAC name of (2S)-2-[[4-[2-(2,4-diamino-5-chloroquinazolin-6-yl)ethyl]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[4-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[5-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methyl-methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid (CID 165054866) is (2S)-2-[[4-[2-(2,4-diamino-5-chloroquinazolin-6-yl)ethyl]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[4-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[5-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methyl-methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid.

What is the SMILES notation for (2S)-2-[[4-[2-(2,4-diamino-5-chloroquinazolin-6-yl)ethyl]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[4-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[5-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methyl-methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid?

The canonical SMILES for (2S)-2-[[4-[2-(2,4-diamino-5-chloroquinazolin-6-yl)ethyl]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[4-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[5-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methyl-methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid is Cc1ccc(C(=O)CCCC[C@H](NC(=O)c2ccc(CCc3ccc4nc(N)nc(N)c4c3Cl)cc2)C(=O)O)c(-c2nn[nH]n2)c1.Cc1ccc(C(=O)CCCC[C@H](NC(=O)c2ccc(NCc3ccc4nc(N)nc(N)c4c3Cl)cc2)C(=O)O)c(-c2nn[nH]n2)c1.Cc1ccc(C(=O)NCCC[C@H](NC(=O)c2ccc(N(C)Cc3cnc4nc(N)nc(N)c4n3)s2)C(=O)O)c(-c2nn[nH]n2)c1.Cc1ccc(C(=O)NCCC[C@H](NC(=O)c2ccc(NCc3ccc4nc(N)nc(N)c4c3Cl)s2)C(=O)O)c(-c2nn[nH]n2)c1.Cc1ccc(C(=O)NCCC[C@H](NC(=O)c2ccc(NCc3cnc4nc(N)nc(N)c4n3)s2)C(=O)O)c(-c2nn[nH]n2)c1.

What is the InChIKey of (2S)-2-[[4-[2-(2,4-diamino-5-chloroquinazolin-6-yl)ethyl]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[4-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[5-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methyl-methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid?

The InChIKey is QGAQRYBEDIDMEC-JSJWZPOKSA-N. The full InChI is InChI=1S/C32H32ClN9O4.C31H31ClN10O4.C28H28ClN11O4S.C27H29N13O4S.C26H27N13O4S/c1-17-6-14-21(22(16-17)29-39-41-42-40-29)25(43)5-3-2-4-24(31(45)46)36-30(44)20-11-8-18(9-12-20)7-10-19-13-15-23-26(27(19)33)28(34)38-32(35)37-23;1-16-6-12-20(21(14-16)28-39-41-42-40-28)24(43)5-3-2-4-23(30(45)46)36-29(44)17-7-10-19(11-8-17)35-15-18-9-13-22-25(26(18)32)27(33)38-31(34)37-22;1-13-4-6-15(16(11-13)24-37-39-40-38-24)25(41)32-10-2-3-18(27(43)44)34-26(42)19-8-9-20(45-19)33-12-14-5-7-17-21(22(14)29)23(30)36-28(31)35-17;1-13-5-6-15(16(10-13)22-36-38-39-37-22)24(41)30-9-3-4-17(26(43)44)33-25(42)18-7-8-19(45-18)40(2)12-14-11-31-23-20(32-14)21(28)34-27(29)35-23;1-12-4-5-14(15(9-12)21-36-38-39-37-21)23(40)29-8-2-3-16(25(42)43)33-24(41)17-6-7-18(44-17)30-10-13-11-31-22-19(32-13)20(27)34-26(28)35-22/h6,8-9,11-16,24H,2-5,7,10H2,1H3,(H,36,44)(H,45,46)(H4,34,35,37,38)(H,39,40,41,42);6-14,23,35H,2-5,15H2,1H3,(H,36,44)(H,45,46)(H4,33,34,37,38)(H,39,40,41,42);4-9,11,18,33H,2-3,10,12H2,1H3,(H,32,41)(H,34,42)(H,43,44)(H4,30,31,35,36)(H,37,38,39,40);5-8,10-11,17H,3-4,9,12H2,1-2H3,(H,30,41)(H,33,42)(H,43,44)(H,36,37,38,39)(H4,28,29,31,34,35);4-7,9,11,16,30H,2-3,8,10H2,1H3,(H,29,40)(H,33,41)(H,42,43)(H,36,37,38,39)(H4,27,28,31,34,35)/t24-;23-;18-;17-;16-/m00000/s1.

What are the key properties of (2S)-2-[[4-[2-(2,4-diamino-5-chloroquinazolin-6-yl)ethyl]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[4-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[5-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methyl-methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid?

(2S)-2-[[4-[2-(2,4-diamino-5-chloroquinazolin-6-yl)ethyl]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[4-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[5-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methyl-methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid has a molecular weight of 3184.69 g/mol, XLogP of 13.83, 62 rotatable bonds, 31 hydrogen bond donors, and 61 hydrogen bond acceptors.

Where does this data come from?

All data for (2S)-2-[[4-[2-(2,4-diamino-5-chloroquinazolin-6-yl)ethyl]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[4-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]benzoyl]amino]-7-[4-methyl-2-(2H-tetrazol-5-yl)phenyl]-7-oxoheptanoic acid;(2S)-2-[[5-[(2,4-diamino-5-chloroquinazolin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid;(2S)-2-[[5-[(2,4-diaminopteridin-6-yl)methyl-methylamino]thiophene-2-carbonyl]amino]-5-[[4-methyl-2-(2H-tetrazol-5-yl)benzoyl]amino]pentanoic acid is sourced from PubChem (CID 165054866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).