COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK462671
Chemical Name: 1-{4-[4-({2-[3-(propan-2-yloxy)phenyl]quinolin-4-yl}carbonyl)piperazin-1-yl]phenyl}ethanone
Smiles: CC(Oc1cccc(c1)c1nc2ccccc2c(c1)C(=O)N1CCN(CC1)c1ccc(cc1)C(=O)C)C

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Molecular Weight: 493.61
Empirical Formula: C31H31N3O3

Physical State: Dry powder
Available Amount: 688 mg

Lipinsky:
logP: 3.966
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 62
Number of rings: 5

     

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