COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK686585
Chemical Name: 2-amino-4-[4-(1H-benzimidazol-1-ylmethyl)thiophen-2-yl]-1-(2-chloropyridin-3-yl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1c1scc(c1)Cn1cnc3c1cccc3)C(=O)CC(C2)(C)C)c1cccnc1Cl

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Molecular Weight: 541.08
Empirical Formula: C29H25ClN6OS

Physical State: Dry powder
Available Amount: 56 mg

Lipinsky:
logP: 3.433
Rotatable bonds: 3
H-donors: 2
H-acceptors: 1
PSA: 129
Number of rings: 6

     

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