COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK754369
Chemical Name: 2-amino-4-(3,4-dimethoxyphenyl)-1-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: COc1ccc(cc1)N1C(=C(C#N)C(C2=C1CC(C)(C)CC2=O)c1ccc(c(c1)OC)OC)N

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Molecular Weight: 459.55
Empirical Formula: C27H29N3O4

Physical State: Dry powder
Available Amount: 46 mg

Lipinsky:
logP: 3.371
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 97
Number of rings: 4

     

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