COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK443214
Chemical Name: (2E)-N-[1-(2-chlorobenzyl)-1H-1,2,4-triazol-3-yl]-3-[3-methoxy-4-(propan-2-yloxy)phenyl]prop-2-enamide
Smiles: COc1cc(/C=C/C(=O)Nc2ncn(n2)Cc2ccccc2Cl)ccc1OC(C)C

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Molecular Weight: 426.9
Empirical Formula: C22H23ClN4O3

Physical State: Dry powder
Available Amount: 760 mg

Lipinsky:
logP: 4.636
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 78
Number of rings: 3

     

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