COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK086993
Chemical Name: 11-(3,4-dimethoxyphenyl)-3-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1ccc(cc1OC)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1cccs1

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Molecular Weight: 432.54
Empirical Formula: C25H24N2O3S

Physical State: Dry powder
Available Amount: 327 mg

Lipinsky:
logP: 3.458
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 87
Number of rings: 5

     

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