COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK826509
Chemical Name: 2-{[3-cyano-7,7-dimethyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)N)NC2=C(C1c1cc(OC)c(c(c1)OC)OC)C(=O)CC(C2)(C)C

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Molecular Weight: 457.55
Empirical Formula: C23H27N3O5S

Physical State: Dry powder
Available Amount: 74 mg

Lipinsky:
logP: 1.53
Rotatable bonds: 5
H-donors: 3
H-acceptors: 5
PSA: 148
Number of rings: 3

     

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