COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK414998
Chemical Name: 3-[4-(dimethylamino)phenyl]-11-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CN(c1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1cccs1)C

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Molecular Weight: 415.56
Empirical Formula: C25H25N3OS

Physical State: Dry powder
Available Amount: 210 mg

Lipinsky:
logP: 3.83
Rotatable bonds: 1
H-donors: 2
H-acceptors: 1
PSA: 72
Number of rings: 5

     

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