CGP78850 | CAS 258326-83-9 | AnyMole

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HIT214323581

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HIT214323581

HIT ID:HIT214323581
Cas No:258326-83-9
常用名:CGP78850
IUPAC:({4-[(2S)-2-[(1-{[(1S)-2-carbamoyl-1-{[3-(2-hydroxynaphthalen-1-yl)propyl]carbamoyl}ethyl]carbamoyl}cyclohexyl)carbamoyl]-2-acetamidoethyl]phenyl}methyl)phosphonic acid
IUPAC:({4-[(2S)-2-[(1-{[(1S)-2-carbamoyl-1-{[3-(2-hydroxynaphthalen-1-yl)propyl]carbamoyl}ethyl]carbamoyl}cyclohexyl)carbamoyl]-2-acetamidoethyl]phenyl}methyl)phosphonic acid
InChI key:DXUDLEHAROCUHM-KYJUHHDHSA-N

分子式:C36H46N5O9P
分子量:723.764
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC(=O)N[C@@H](Cc1ccc(CP(O)(O)=O)cc1)C(=O)NC1(CCCCC1)C(=O)N[C@@H](CC(N)=O)C(=O)NCCCc1c(O)ccc2ccccc12
SMILES:CC(=O)N[C@@H](Cc1ccc(CP(O)(O)=O)cc1)C(=O)NC1(CCCCC1)C(=O)N[C@@H](CC(N)=O)C(=O)NCCCc1c(O)ccc2ccccc12

CGP78850 is a potent and selective Grb2 SH2-phosphopeptide interaction antagonist that holds potential for cancer research.

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