COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK565144
Chemical Name: (1'S,2'S,3R,3a'R)-7'-chloro-1'-(2,2-dimethylpropanoyl)-5'-methyl-2'-[(4-pentylphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: CCCCCc1ccc(cc1)C(=O)[C@@H]1[C@H](N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=C(c1c2ccc(c1)Cl)C)C(=O)C(C)(C)C

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Molecular Weight: 595.18
Empirical Formula: C37H39ClN2O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 9.846
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 66
Number of rings: 6

     

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