COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK326270
Chemical Name: 11-[4-(methylsulfanyl)phenyl]-3-(3,4,5-trimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CSc1ccc(cc1)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1cc(OC)c(c(c1)OC)OC

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Molecular Weight: 502.63
Empirical Formula: C29H30N2O4S

Physical State: Dry powder
Available Amount: 360 mg

Lipinsky:
logP: 3.968
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 94
Number of rings: 5

     

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