N'-[(3S,5S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-5-[[(1S)-3-[3-[(1S)-2-[(2S,4S)-4-[[4-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethylamino]-4-oxobutanoyl]amino]-2-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)pyrrolidin-1-yl]-1-[[(2S)-2-(methylamino)propanoyl]amino]-2-oxoethyl]cyclohexyl]-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl]pyrrolidin-3-yl]-N-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethyl]butanediamide

C150H210F4N32O16 — CID 174285275

About N'-[(3S,5S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-5-[[(1S)-3-[3-[(1S)-2-[(2S,4S)-4-[[4-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethylamino]-4-oxobutanoyl]amino]-2-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)pyrrolidin-1-yl]-1-[[(2S)-2-(methylamino)propanoyl]amino]-2-oxoethyl]cyclohexyl]-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl]pyrrolidin-3-yl]-N-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethyl]butanediamide

N'-[(3S,5S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-5-[[(1S)-3-[3-[(1S)-2-[(2S,4S)-4-[[4-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethylamino]-4-oxobutanoyl]amino]-2-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)pyrrolidin-1-yl]-1-[[(2S)-2-(methylamino)propanoyl]amino]-2-oxoethyl]cyclohexyl]-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl]pyrrolidin-3-yl]-N-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethyl]butanediamide (PubChem CID 174285275) has the molecular formula C150H210F4N32O16 and a molecular weight of 2793.53 g/mol. Its IUPAC name is N'-[(3S,5S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-5-[[(1S)-3-[3-[(1S)-2-[(2S,4S)-4-[[4-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethylamino]-4-oxobutanoyl]amino]-2-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)pyrrolidin-1-yl]-1-[[(2S)-2-(methylamino)propanoyl]amino]-2-oxoethyl]cyclohexyl]-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl]pyrrolidin-3-yl]-N-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethyl]butanediamide.

Molecular Properties

• Compound Name: N'-[(3S,5S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-5-[[(1S)-3-[3-[(1S)-2-[(2S,4S)-4-[[4-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethylamino]-4-oxobutanoyl]amino]-2-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)pyrrolidin-1-yl]-1-[[(2S)-2-(methylamino)propanoyl]amino]-2-oxoethyl]cyclohexyl]-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl]pyrrolidin-3-yl]-N-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethyl]butanediamide
• PubChem CID: 174285275
• Molecular Formula: C150H210F4N32O16
• Molecular Weight: 2793.53 g/mol
• Exact Mass: 2791.65
• IUPAC Name: N'-[(3S,5S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-5-[[(1S)-3-[3-[(1S)-2-[(2S,4S)-4-[[4-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethylamino]-4-oxobutanoyl]amino]-2-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)pyrrolidin-1-yl]-1-[[(2S)-2-(methylamino)propanoyl]amino]-2-oxoethyl]cyclohexyl]-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl]pyrrolidin-3-yl]-N-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethyl]butanediamide
• SMILES: CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@@H](NC(=O)CCC(=O)NCCOCCN2CCN(CC(=O)NCc3cccc(CNc4cc(N5CCC6(CC5)CN(c5cc(F)c(CN7CCC(C)(C)CC7)cc5F)CC(=O)N6)ncn4)c3)CC2)C[C@H]1C(=O)NC1CCCc2ccccc21)C1CCCC(C2Cc3ccccc3[C@@H](NC(=O)[C@@H]3C[C@H](NC(=O)CCC(=O)NCCOCCN4CCN(CC(=O)NCc5cccc(CNc6cc(N7CCC8(CC7)CN(c7cc(F)c(CN9CCC(C)(C)CC9)cc7F)CC(=O)N8)ncn6)c5)CC4)CN3C(=O)[C@@H](NC(=O)[C@H](C)NC)C3CCCCC3)C2)C1
• InChI: InChI=1S/C150H210F4N32O16/c1-99(155-7)141(195)171-139(106-25-10-9-11-26-106)145(199)185-89-114(168-134(190)37-35-132(188)158-47-67-202-69-65-176-58-62-180(63-59-176)92-136(192)162-86-104-23-17-21-102(71-104)84-160-128-82-130(166-98-164-128)182-54-44-150(45-55-182)96-184(94-138(194)174-150)124-80-118(152)112(75-120(124)154)88-178-50-40-148(5,6)41-51-178)78-126(185)144(198)170-122-76-110(73-108-27-13-15-32-116(108)122)107-29-18-30-109(72-107)140(172-142(196)100(2)156-8)146(200)186-90-113(77-125(186)143(197)169-121-33-19-28-105-24-12-14-31-115(105)121)167-133(189)36-34-131(187)157-46-66-201-68-64-175-56-60-179(61-57-175)91-135(191)161-85-103-22-16-20-101(70-103)83-159-127-81-129(165-97-163-127)181-52-42-149(43-53-181)95-183(93-137(193)173-149)123-79-117(151)111(74-119(123)153)87-177-48-38-147(3,4)39-49-177/h12-17,20-24,27,31-32,70-71,74-75,79-82,97-100,106-107,109-110,113-114,121-122,125-126,139-140,155-156H,9-11,18-19,25-26,28-30,33-69,72-73,76-78,83-96H2,1-8H3,(H,157,187)(H,158,188)(H,161,191)(H,162,192)(H,167,189)(H,168,190)(H,169,197)(H,170,198)(H,171,195)(H,172,196)(H,173,193)(H,174,194)(H,159,163,165)(H,160,164,166)/t99-,100-,107?,109?,110?,113-,114-,121?,122-,125-,126-,139-,140-/m0/s1
• InChIKey: OEBYTZXXDDMQSW-ZBMCELEESA-N
• XLogP: 9.59
• TPSA: 540.36 Ų
• H-Bond Donors: 16
• H-Bond Acceptors: 34
• Rotatable Bonds: 57
• Heavy Atoms: 202
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2793.53
LogP ≤ 5	9.59
H-Bond Donors ≤ 5	16
H-Bond Acceptors ≤ 10	34

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N'-[(3S,5S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-5-[[(1S)-3-[3-[(1S)-2-[(2S,4S)-4-[[4-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethylamino]-4-oxobutanoyl]amino]-2-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)pyrrolidin-1-yl]-1-[[(2S)-2-(methylamino)propanoyl]amino]-2-oxoethyl]cyclohexyl]-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl]pyrrolidin-3-yl]-N-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethyl]butanediamide?

The IUPAC name of N'-[(3S,5S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-5-[[(1S)-3-[3-[(1S)-2-[(2S,4S)-4-[[4-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethylamino]-4-oxobutanoyl]amino]-2-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)pyrrolidin-1-yl]-1-[[(2S)-2-(methylamino)propanoyl]amino]-2-oxoethyl]cyclohexyl]-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl]pyrrolidin-3-yl]-N-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethyl]butanediamide (CID 174285275) is N'-[(3S,5S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-5-[[(1S)-3-[3-[(1S)-2-[(2S,4S)-4-[[4-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethylamino]-4-oxobutanoyl]amino]-2-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)pyrrolidin-1-yl]-1-[[(2S)-2-(methylamino)propanoyl]amino]-2-oxoethyl]cyclohexyl]-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl]pyrrolidin-3-yl]-N-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethyl]butanediamide.

What is the SMILES notation for N'-[(3S,5S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-5-[[(1S)-3-[3-[(1S)-2-[(2S,4S)-4-[[4-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethylamino]-4-oxobutanoyl]amino]-2-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)pyrrolidin-1-yl]-1-[[(2S)-2-(methylamino)propanoyl]amino]-2-oxoethyl]cyclohexyl]-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl]pyrrolidin-3-yl]-N-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethyl]butanediamide?

The canonical SMILES for N'-[(3S,5S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-5-[[(1S)-3-[3-[(1S)-2-[(2S,4S)-4-[[4-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethylamino]-4-oxobutanoyl]amino]-2-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)pyrrolidin-1-yl]-1-[[(2S)-2-(methylamino)propanoyl]amino]-2-oxoethyl]cyclohexyl]-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl]pyrrolidin-3-yl]-N-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethyl]butanediamide is CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@@H](NC(=O)CCC(=O)NCCOCCN2CCN(CC(=O)NCc3cccc(CNc4cc(N5CCC6(CC5)CN(c5cc(F)c(CN7CCC(C)(C)CC7)cc5F)CC(=O)N6)ncn4)c3)CC2)C[C@H]1C(=O)NC1CCCc2ccccc21)C1CCCC(C2Cc3ccccc3[C@@H](NC(=O)[C@@H]3C[C@H](NC(=O)CCC(=O)NCCOCCN4CCN(CC(=O)NCc5cccc(CNc6cc(N7CCC8(CC7)CN(c7cc(F)c(CN9CCC(C)(C)CC9)cc7F)CC(=O)N8)ncn6)c5)CC4)CN3C(=O)[C@@H](NC(=O)[C@H](C)NC)C3CCCCC3)C2)C1.

What is the InChIKey of N'-[(3S,5S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-5-[[(1S)-3-[3-[(1S)-2-[(2S,4S)-4-[[4-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethylamino]-4-oxobutanoyl]amino]-2-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)pyrrolidin-1-yl]-1-[[(2S)-2-(methylamino)propanoyl]amino]-2-oxoethyl]cyclohexyl]-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl]pyrrolidin-3-yl]-N-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethyl]butanediamide?

The InChIKey is OEBYTZXXDDMQSW-ZBMCELEESA-N. The full InChI is InChI=1S/C150H210F4N32O16/c1-99(155-7)141(195)171-139(106-25-10-9-11-26-106)145(199)185-89-114(168-134(190)37-35-132(188)158-47-67-202-69-65-176-58-62-180(63-59-176)92-136(192)162-86-104-23-17-21-102(71-104)84-160-128-82-130(166-98-164-128)182-54-44-150(45-55-182)96-184(94-138(194)174-150)124-80-118(152)112(75-120(124)154)88-178-50-40-148(5,6)41-51-178)78-126(185)144(198)170-122-76-110(73-108-27-13-15-32-116(108)122)107-29-18-30-109(72-107)140(172-142(196)100(2)156-8)146(200)186-90-113(77-125(186)143(197)169-121-33-19-28-105-24-12-14-31-115(105)121)167-133(189)36-34-131(187)157-46-66-201-68-64-175-56-60-179(61-57-175)91-135(191)161-85-103-22-16-20-101(70-103)83-159-127-81-129(165-97-163-127)181-52-42-149(43-53-181)95-183(93-137(193)173-149)123-79-117(151)111(74-119(123)153)87-177-48-38-147(3,4)39-49-177/h12-17,20-24,27,31-32,70-71,74-75,79-82,97-100,106-107,109-110,113-114,121-122,125-126,139-140,155-156H,9-11,18-19,25-26,28-30,33-69,72-73,76-78,83-96H2,1-8H3,(H,157,187)(H,158,188)(H,161,191)(H,162,192)(H,167,189)(H,168,190)(H,169,197)(H,170,198)(H,171,195)(H,172,196)(H,173,193)(H,174,194)(H,159,163,165)(H,160,164,166)/t99-,100-,107?,109?,110?,113-,114-,121?,122-,125-,126-,139-,140-/m0/s1.

What are the key properties of N'-[(3S,5S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-5-[[(1S)-3-[3-[(1S)-2-[(2S,4S)-4-[[4-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethylamino]-4-oxobutanoyl]amino]-2-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)pyrrolidin-1-yl]-1-[[(2S)-2-(methylamino)propanoyl]amino]-2-oxoethyl]cyclohexyl]-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl]pyrrolidin-3-yl]-N-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethyl]butanediamide?

N'-[(3S,5S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-5-[[(1S)-3-[3-[(1S)-2-[(2S,4S)-4-[[4-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethylamino]-4-oxobutanoyl]amino]-2-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)pyrrolidin-1-yl]-1-[[(2S)-2-(methylamino)propanoyl]amino]-2-oxoethyl]cyclohexyl]-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl]pyrrolidin-3-yl]-N-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethyl]butanediamide has a molecular weight of 2793.53 g/mol, XLogP of 9.59, 57 rotatable bonds, 16 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for N'-[(3S,5S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-5-[[(1S)-3-[3-[(1S)-2-[(2S,4S)-4-[[4-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethylamino]-4-oxobutanoyl]amino]-2-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)pyrrolidin-1-yl]-1-[[(2S)-2-(methylamino)propanoyl]amino]-2-oxoethyl]cyclohexyl]-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl]pyrrolidin-3-yl]-N-[2-[2-[4-[2-[[3-[[[6-[4-[4-[(4,4-dimethylpiperidin-1-yl)methyl]-2,5-difluorophenyl]-2-oxo-1,4,9-triazaspiro[5.5]undecan-9-yl]pyrimidin-4-yl]amino]methyl]phenyl]methylamino]-2-oxoethyl]piperazin-1-yl]ethoxy]ethyl]butanediamide is sourced from PubChem (CID 174285275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).