COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK760832
Chemical Name: 2-amino-1-benzyl-4-(4-chlorophenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(Cc2ccccc2)C2=C(C1c1ccc(cc1)Cl)C(=O)CC(C2)(C)C

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Molecular Weight: 417.94
Empirical Formula: C25H24ClN3O

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.723
Rotatable bonds: 1
H-donors: 2
H-acceptors: 1
PSA: 70
Number of rings: 4

     

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