COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK783141
Chemical Name: 2-amino-1-(4-chlorophenyl)-7,7-dimethyl-5-oxo-4-[4-(1H-1,2,4-triazol-1-ylmethyl)thiophen-2-yl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2ccc(cc2)Cl)C2=C(C1c1scc(c1)Cn1ncnc1)C(=O)CC(C2)(C)C

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Molecular Weight: 491.02
Empirical Formula: C25H23ClN6OS

Physical State: Dry powder
Available Amount: 65 mg

Lipinsky:
logP: 2.723
Rotatable bonds: 3
H-donors: 2
H-acceptors: 1
PSA: 129
Number of rings: 5

     

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