COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK263084
Chemical Name: 3,3-dimethyl-11-(3-methylthiophen-2-yl)-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCC(=O)N1c2ccccc2NC2=C(C1c1sccc1C)C(=O)CC(C2)(C)C

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Molecular Weight: 394.54
Empirical Formula: C23H26N2O2S

Physical State: Dry powder
Available Amount: 122 mg

Lipinsky:
logP: 4.513
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 77
Number of rings: 4

     

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