COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK060578
Chemical Name: 11-(6-chloro-4-oxo-4H-chromen-3-yl)-3-(3,4-dimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1coc2c(c1=O)cc(cc2)Cl

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Molecular Weight: 528.99
Empirical Formula: C30H25ClN2O5

Physical State: Dry powder
Available Amount: 509 mg

Lipinsky:
logP: 4.504
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 85
Number of rings: 6

     

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