COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK043482
Chemical Name: 11-(4-hydroxy-3,5-dimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1cc(cc(c1O)OC)C1Nc2ccccc2NC2=C1C(=O)CCC2

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Molecular Weight: 366.42
Empirical Formula: C21H22N2O4

Physical State: Dry powder
Available Amount: 142 mg

Lipinsky:
logP: 0.932
Rotatable bonds: 3
H-donors: 3
H-acceptors: 4
PSA: 79
Number of rings: 4

     

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