(3R)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[5-[[4-[3-[2-[3-[2-[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]ethoxy]propoxy]ethylamino]-3-oxopropyl]-7-[3-[3-[[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]propoxy]propylamino]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]pentoxy]ethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid

C165H221N25O34 — CID 166496286

About (3R)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[5-[[4-[3-[2-[3-[2-[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]ethoxy]propoxy]ethylamino]-3-oxopropyl]-7-[3-[3-[[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]propoxy]propylamino]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]pentoxy]ethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid

(3R)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[5-[[4-[3-[2-[3-[2-[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]ethoxy]propoxy]ethylamino]-3-oxopropyl]-7-[3-[3-[[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]propoxy]propylamino]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]pentoxy]ethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid (PubChem CID 166496286) has the molecular formula C165H221N25O34 and a molecular weight of 3098.72 g/mol. Its IUPAC name is (3R)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[5-[[4-[3-[2-[3-[2-[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]ethoxy]propoxy]ethylamino]-3-oxopropyl]-7-[3-[3-[[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]propoxy]propylamino]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]pentoxy]ethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid.

Molecular Properties

• Compound Name: (3R)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[5-[[4-[3-[2-[3-[2-[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]ethoxy]propoxy]ethylamino]-3-oxopropyl]-7-[3-[3-[[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]propoxy]propylamino]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]pentoxy]ethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid
• PubChem CID: 166496286
• Molecular Formula: C165H221N25O34
• Molecular Weight: 3098.72 g/mol
• Exact Mass: 3096.63
• IUPAC Name: (3R)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[5-[[4-[3-[2-[3-[2-[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]ethoxy]propoxy]ethylamino]-3-oxopropyl]-7-[3-[3-[[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]propoxy]propylamino]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]pentoxy]ethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid
• SMILES: Cc1ccnc(NCCCC(=O)N[C@@H](COCCOCCOCCOCCn2cc(CCOCCCCCNC(=O)CCC(CCC(=O)NCCCOCCCOCc3cn(CCOCCOCCOCCOC[C@H](NC(=O)CCCNc4cc(C)ccn4)C(=O)N[C@H](CC(=O)O)c4ccc(-c5cccc6ccccc56)cc4)nn3)(CCC(=O)NCCOCCCOCCc3cn(CCOCCOCCOCCOC[C@H](NC(=O)CCCNc4cc(C)ccn4)C(=O)N[C@H](CC(=O)O)c4ccc(-c5cccc6ccccc56)cc4)nn3)NC(=O)CCCC(=O)C(C)C)nn2)C(=O)N[C@H](CC(=O)O)c2ccc(-c3cccc4ccccc34)cc2)c1
• InChI: InChI=1S/C165H221N25O34/c1-120(2)148(191)37-18-38-158(198)181-165(62-54-152(192)172-65-13-6-14-77-209-83-60-133-113-188(185-182-133)74-86-212-89-92-215-95-98-218-101-104-222-117-145(175-155(195)39-19-66-166-149-107-121(3)57-70-169-149)162(205)178-142(110-159(199)200)130-48-42-127(43-49-130)139-34-15-28-124-25-7-10-31-136(124)139,63-55-153(193)173-69-22-78-208-79-24-82-221-116-135-115-190(187-184-135)76-88-214-91-94-217-97-100-220-103-106-224-119-147(177-157(197)41-21-68-168-151-109-123(5)59-72-171-151)164(207)180-144(112-161(203)204)132-52-46-129(47-53-132)141-36-17-30-126-27-9-12-33-138(126)141)64-56-154(194)174-73-85-211-81-23-80-210-84-61-134-114-189(186-183-134)75-87-213-90-93-216-96-99-219-102-105-223-118-146(176-156(196)40-20-67-167-150-108-122(4)58-71-170-150)163(206)179-143(111-160(201)202)131-50-44-128(45-51-131)140-35-16-29-125-26-8-11-32-137(125)140/h7-12,15-17,25-36,42-53,57-59,70-72,107-109,113-115,120,142-147H,6,13-14,18-24,37-41,54-56,60-69,73-106,110-112,116-119H2,1-5H3,(H,166,169)(H,167,170)(H,168,171)(H,172,192)(H,173,193)(H,174,194)(H,175,195)(H,176,196)(H,177,197)(H,178,205)(H,179,206)(H,180,207)(H,181,198)(H,199,200)(H,201,202)(H,203,204)/t142-,143-,144-,145+,146+,147+,165?/m1/s1
• InChIKey: BWGOIFKTRBSMJX-YFUICTBKSA-N
• XLogP: 16.71
• TPSA: 743.77 Ų
• H-Bond Donors: 16
• H-Bond Acceptors: 46
• Rotatable Bonds: 122
• Heavy Atoms: 224
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3098.72
LogP ≤ 5	16.71
H-Bond Donors ≤ 5	16
H-Bond Acceptors ≤ 10	46

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (3R)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[5-[[4-[3-[2-[3-[2-[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]ethoxy]propoxy]ethylamino]-3-oxopropyl]-7-[3-[3-[[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]propoxy]propylamino]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]pentoxy]ethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid?

The IUPAC name of (3R)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[5-[[4-[3-[2-[3-[2-[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]ethoxy]propoxy]ethylamino]-3-oxopropyl]-7-[3-[3-[[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]propoxy]propylamino]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]pentoxy]ethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid (CID 166496286) is (3R)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[5-[[4-[3-[2-[3-[2-[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]ethoxy]propoxy]ethylamino]-3-oxopropyl]-7-[3-[3-[[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]propoxy]propylamino]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]pentoxy]ethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid.

What is the SMILES notation for (3R)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[5-[[4-[3-[2-[3-[2-[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]ethoxy]propoxy]ethylamino]-3-oxopropyl]-7-[3-[3-[[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]propoxy]propylamino]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]pentoxy]ethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid?

The canonical SMILES for (3R)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[5-[[4-[3-[2-[3-[2-[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]ethoxy]propoxy]ethylamino]-3-oxopropyl]-7-[3-[3-[[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]propoxy]propylamino]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]pentoxy]ethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid is Cc1ccnc(NCCCC(=O)N[C@@H](COCCOCCOCCOCCn2cc(CCOCCCCCNC(=O)CCC(CCC(=O)NCCCOCCCOCc3cn(CCOCCOCCOCCOC[C@H](NC(=O)CCCNc4cc(C)ccn4)C(=O)N[C@H](CC(=O)O)c4ccc(-c5cccc6ccccc56)cc4)nn3)(CCC(=O)NCCOCCCOCCc3cn(CCOCCOCCOCCOC[C@H](NC(=O)CCCNc4cc(C)ccn4)C(=O)N[C@H](CC(=O)O)c4ccc(-c5cccc6ccccc56)cc4)nn3)NC(=O)CCCC(=O)C(C)C)nn2)C(=O)N[C@H](CC(=O)O)c2ccc(-c3cccc4ccccc34)cc2)c1.

What is the InChIKey of (3R)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[5-[[4-[3-[2-[3-[2-[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]ethoxy]propoxy]ethylamino]-3-oxopropyl]-7-[3-[3-[[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]propoxy]propylamino]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]pentoxy]ethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid?

The InChIKey is BWGOIFKTRBSMJX-YFUICTBKSA-N. The full InChI is InChI=1S/C165H221N25O34/c1-120(2)148(191)37-18-38-158(198)181-165(62-54-152(192)172-65-13-6-14-77-209-83-60-133-113-188(185-182-133)74-86-212-89-92-215-95-98-218-101-104-222-117-145(175-155(195)39-19-66-166-149-107-121(3)57-70-169-149)162(205)178-142(110-159(199)200)130-48-42-127(43-49-130)139-34-15-28-124-25-7-10-31-136(124)139,63-55-153(193)173-69-22-78-208-79-24-82-221-116-135-115-190(187-184-135)76-88-214-91-94-217-97-100-220-103-106-224-119-147(177-157(197)41-21-68-168-151-109-123(5)59-72-171-151)164(207)180-144(112-161(203)204)132-52-46-129(47-53-132)141-36-17-30-126-27-9-12-33-138(126)141)64-56-154(194)174-73-85-211-81-23-80-210-84-61-134-114-189(186-183-134)75-87-213-90-93-216-96-99-219-102-105-223-118-146(176-156(196)40-20-67-167-150-108-122(4)58-71-170-150)163(206)179-143(111-160(201)202)131-50-44-128(45-51-131)140-35-16-29-125-26-8-11-32-137(125)140/h7-12,15-17,25-36,42-53,57-59,70-72,107-109,113-115,120,142-147H,6,13-14,18-24,37-41,54-56,60-69,73-106,110-112,116-119H2,1-5H3,(H,166,169)(H,167,170)(H,168,171)(H,172,192)(H,173,193)(H,174,194)(H,175,195)(H,176,196)(H,177,197)(H,178,205)(H,179,206)(H,180,207)(H,181,198)(H,199,200)(H,201,202)(H,203,204)/t142-,143-,144-,145+,146+,147+,165?/m1/s1.

What are the key properties of (3R)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[5-[[4-[3-[2-[3-[2-[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]ethoxy]propoxy]ethylamino]-3-oxopropyl]-7-[3-[3-[[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]propoxy]propylamino]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]pentoxy]ethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid?

(3R)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[5-[[4-[3-[2-[3-[2-[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]ethoxy]propoxy]ethylamino]-3-oxopropyl]-7-[3-[3-[[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]propoxy]propylamino]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]pentoxy]ethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid has a molecular weight of 3098.72 g/mol, XLogP of 16.71, 122 rotatable bonds, 16 hydrogen bond donors, and 46 hydrogen bond acceptors.

Where does this data come from?

All data for (3R)-3-[[(2S)-3-[2-[2-[2-[2-[4-[2-[5-[[4-[3-[2-[3-[2-[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]ethoxy]propoxy]ethylamino]-3-oxopropyl]-7-[3-[3-[[1-[2-[2-[2-[2-[(2S)-3-[[(1R)-2-carboxy-1-(4-naphthalen-1-ylphenyl)ethyl]amino]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]propoxy]propylamino]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]pentoxy]ethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]-2-[4-[(4-methyl-2-pyridinyl)amino]butanoylamino]propanoyl]amino]-3-(4-naphthalen-1-ylphenyl)propanoic acid is sourced from PubChem (CID 166496286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).