COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK781412
Chemical Name: 1-(3-chloro-4-fluorophenyl)-7,7-dimethyl-4-(3-methylthiophen-2-yl)-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(c2ccc(c(c2)Cl)F)C2=C(C1c1sccc1C)C(=O)CC(C2)(C)C

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Molecular Weight: 492.02
Empirical Formula: C27H23ClFN3OS

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.343
Rotatable bonds: 1
H-donors: 0
H-acceptors: 1
PSA: 77
Number of rings: 5

     

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