COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK731226
Chemical Name: N-{(1Z)-1-(2-chloro-7-methylquinolin-3-yl)-3-[(2-hydroxyethyl)amino]-3-oxoprop-1-en-2-yl}benzamide
Smiles: OCCNC(=O)/C(=C/c1cc2ccc(cc2nc1Cl)C)/NC(=O)c1ccccc1

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Molecular Weight: 409.87
Empirical Formula: C22H20ClN3O3

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 1.82
Rotatable bonds: 5
H-donors: 3
H-acceptors: 3
PSA: 91
Number of rings: 3

     

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