(3S)-3-[4-[4-[2-[2-[2-[2-[2-[4-[2-[[7-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-4-[3-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-3-oxopropyl]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]naphthalen-1-yl]phenyl]-5-[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidin-2-yl]-5-oxopentanoic acid

C166H216N24O35 — CID 167690943

About (3S)-3-[4-[4-[2-[2-[2-[2-[2-[4-[2-[[7-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-4-[3-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-3-oxopropyl]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]naphthalen-1-yl]phenyl]-5-[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidin-2-yl]-5-oxopentanoic acid

(3S)-3-[4-[4-[2-[2-[2-[2-[2-[4-[2-[[7-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-4-[3-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-3-oxopropyl]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]naphthalen-1-yl]phenyl]-5-[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidin-2-yl]-5-oxopentanoic acid (PubChem CID 167690943) has the molecular formula C166H216N24O35 and a molecular weight of 3107.69 g/mol. Its IUPAC name is (3S)-3-[4-[4-[2-[2-[2-[2-[2-[4-[2-[[7-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-4-[3-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-3-oxopropyl]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]naphthalen-1-yl]phenyl]-5-[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidin-2-yl]-5-oxopentanoic acid.

Molecular Properties

• Compound Name: (3S)-3-[4-[4-[2-[2-[2-[2-[2-[4-[2-[[7-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-4-[3-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-3-oxopropyl]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]naphthalen-1-yl]phenyl]-5-[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidin-2-yl]-5-oxopentanoic acid
• PubChem CID: 167690943
• Molecular Formula: C166H216N24O35
• Molecular Weight: 3107.69 g/mol
• Exact Mass: 3105.59
• IUPAC Name: (3S)-3-[4-[4-[2-[2-[2-[2-[2-[4-[2-[[7-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-4-[3-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-3-oxopropyl]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]naphthalen-1-yl]phenyl]-5-[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidin-2-yl]-5-oxopentanoic acid
• SMILES: Cc1ccnc(NCCCC(=O)N2CCC[C@H]2C(=O)C[C@@H](CC(=O)O)c2ccc(-c3ccc(OCCOCCOCCOCCOCCn4cc(COCCNC(=O)CCC(CCC(=O)NCCOCc5cn(CCOCCOCCOCCOCCOc6ccc(-c7ccc([C@H](CC(=O)O)NC(=O)[C@@H]8CCCN8C(=O)CCCNc8cc(C)ccn8)cc7)c7ccccc67)nn5)(CCC(=O)NCCOCc5cn(CCOCCOCCOCCOCCOc6ccc(-c7ccc([C@H](CC(=O)O)NC(=O)[C@@H]8CCCN8C(=O)CCCNc8cc(C)ccn8)cc7)c7ccccc67)nn5)NC(=O)CCCC(=O)C(C)C)nn4)c4ccccc34)cc2)c1
• InChI: InChI=1S/C166H216N24O35/c1-118(2)146(191)28-12-29-157(196)178-166(57-51-154(193)173-66-75-220-115-129-112-185(182-179-129)72-78-208-81-84-211-87-90-214-93-96-217-99-102-223-148-48-45-132(135-19-6-9-22-138(135)148)123-35-33-122(34-36-123)128(109-161(200)201)108-147(192)143-25-16-69-188(143)158(197)30-13-60-167-151-105-119(3)54-63-170-151,58-52-155(194)174-67-76-221-116-130-113-186(183-180-130)73-79-209-82-85-212-88-91-215-94-97-218-100-103-224-149-49-46-133(136-20-7-10-23-139(136)149)124-37-41-126(42-38-124)141(110-162(202)203)176-164(206)144-26-17-70-189(144)159(198)31-14-61-168-152-106-120(4)55-64-171-152)59-53-156(195)175-68-77-222-117-131-114-187(184-181-131)74-80-210-83-86-213-89-92-216-95-98-219-101-104-225-150-50-47-134(137-21-8-11-24-140(137)150)125-39-43-127(44-40-125)142(111-163(204)205)177-165(207)145-27-18-71-190(145)160(199)32-15-62-169-153-107-121(5)56-65-172-153/h6-11,19-24,33-50,54-56,63-65,105-107,112-114,118,128,141-145H,12-18,25-32,51-53,57-62,66-104,108-111,115-117H2,1-5H3,(H,167,170)(H,168,171)(H,169,172)(H,173,193)(H,174,194)(H,175,195)(H,176,206)(H,177,207)(H,178,196)(H,200,201)(H,202,203)(H,204,205)/t128-,141-,142-,143-,144-,145-/m0/s1
• InChIKey: WXVSIRLLPQOMKL-JLFAVBOBSA-N
• XLogP: 17.79
• TPSA: 714.60 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 47
• Rotatable Bonds: 112
• Heavy Atoms: 225
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3107.69
LogP ≤ 5	17.79
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	47

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (3S)-3-[4-[4-[2-[2-[2-[2-[2-[4-[2-[[7-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-4-[3-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-3-oxopropyl]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]naphthalen-1-yl]phenyl]-5-[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidin-2-yl]-5-oxopentanoic acid?

The IUPAC name of (3S)-3-[4-[4-[2-[2-[2-[2-[2-[4-[2-[[7-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-4-[3-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-3-oxopropyl]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]naphthalen-1-yl]phenyl]-5-[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidin-2-yl]-5-oxopentanoic acid (CID 167690943) is (3S)-3-[4-[4-[2-[2-[2-[2-[2-[4-[2-[[7-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-4-[3-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-3-oxopropyl]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]naphthalen-1-yl]phenyl]-5-[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidin-2-yl]-5-oxopentanoic acid.

What is the SMILES notation for (3S)-3-[4-[4-[2-[2-[2-[2-[2-[4-[2-[[7-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-4-[3-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-3-oxopropyl]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]naphthalen-1-yl]phenyl]-5-[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidin-2-yl]-5-oxopentanoic acid?

The canonical SMILES for (3S)-3-[4-[4-[2-[2-[2-[2-[2-[4-[2-[[7-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-4-[3-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-3-oxopropyl]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]naphthalen-1-yl]phenyl]-5-[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidin-2-yl]-5-oxopentanoic acid is Cc1ccnc(NCCCC(=O)N2CCC[C@H]2C(=O)C[C@@H](CC(=O)O)c2ccc(-c3ccc(OCCOCCOCCOCCOCCn4cc(COCCNC(=O)CCC(CCC(=O)NCCOCc5cn(CCOCCOCCOCCOCCOc6ccc(-c7ccc([C@H](CC(=O)O)NC(=O)[C@@H]8CCCN8C(=O)CCCNc8cc(C)ccn8)cc7)c7ccccc67)nn5)(CCC(=O)NCCOCc5cn(CCOCCOCCOCCOCCOc6ccc(-c7ccc([C@H](CC(=O)O)NC(=O)[C@@H]8CCCN8C(=O)CCCNc8cc(C)ccn8)cc7)c7ccccc67)nn5)NC(=O)CCCC(=O)C(C)C)nn4)c4ccccc34)cc2)c1.

What is the InChIKey of (3S)-3-[4-[4-[2-[2-[2-[2-[2-[4-[2-[[7-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-4-[3-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-3-oxopropyl]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]naphthalen-1-yl]phenyl]-5-[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidin-2-yl]-5-oxopentanoic acid?

The InChIKey is WXVSIRLLPQOMKL-JLFAVBOBSA-N. The full InChI is InChI=1S/C166H216N24O35/c1-118(2)146(191)28-12-29-157(196)178-166(57-51-154(193)173-66-75-220-115-129-112-185(182-179-129)72-78-208-81-84-211-87-90-214-93-96-217-99-102-223-148-48-45-132(135-19-6-9-22-138(135)148)123-35-33-122(34-36-123)128(109-161(200)201)108-147(192)143-25-16-69-188(143)158(197)30-13-60-167-151-105-119(3)54-63-170-151,58-52-155(194)174-67-76-221-116-130-113-186(183-180-130)73-79-209-82-85-212-88-91-215-94-97-218-100-103-224-149-49-46-133(136-20-7-10-23-139(136)149)124-37-41-126(42-38-124)141(110-162(202)203)176-164(206)144-26-17-70-189(144)159(198)31-14-61-168-152-106-120(4)55-64-171-152)59-53-156(195)175-68-77-222-117-131-114-187(184-181-131)74-80-210-83-86-213-89-92-216-95-98-219-101-104-225-150-50-47-134(137-21-8-11-24-140(137)150)125-39-43-127(44-40-125)142(111-163(204)205)177-165(207)145-27-18-71-190(145)160(199)32-15-62-169-153-107-121(5)56-65-172-153/h6-11,19-24,33-50,54-56,63-65,105-107,112-114,118,128,141-145H,12-18,25-32,51-53,57-62,66-104,108-111,115-117H2,1-5H3,(H,167,170)(H,168,171)(H,169,172)(H,173,193)(H,174,194)(H,175,195)(H,176,206)(H,177,207)(H,178,196)(H,200,201)(H,202,203)(H,204,205)/t128-,141-,142-,143-,144-,145-/m0/s1.

What are the key properties of (3S)-3-[4-[4-[2-[2-[2-[2-[2-[4-[2-[[7-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-4-[3-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-3-oxopropyl]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]naphthalen-1-yl]phenyl]-5-[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidin-2-yl]-5-oxopentanoic acid?

(3S)-3-[4-[4-[2-[2-[2-[2-[2-[4-[2-[[7-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-4-[3-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-3-oxopropyl]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]naphthalen-1-yl]phenyl]-5-[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidin-2-yl]-5-oxopentanoic acid has a molecular weight of 3107.69 g/mol, XLogP of 17.79, 112 rotatable bonds, 12 hydrogen bond donors, and 47 hydrogen bond acceptors.

Where does this data come from?

All data for (3S)-3-[4-[4-[2-[2-[2-[2-[2-[4-[2-[[7-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-4-[3-[2-[[1-[2-[2-[2-[2-[2-[4-[4-[(1S)-2-carboxy-1-[[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]ethyl]phenyl]naphthalen-1-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]triazol-4-yl]methoxy]ethylamino]-3-oxopropyl]-4-[(6-methyl-5-oxoheptanoyl)amino]-7-oxoheptanoyl]amino]ethoxymethyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]naphthalen-1-yl]phenyl]-5-[(2S)-1-[4-[(4-methyl-2-pyridinyl)amino]butanoyl]pyrrolidin-2-yl]-5-oxopentanoic acid is sourced from PubChem (CID 167690943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).