COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK324682
Chemical Name: 10-acetyl-3,3-dimethyl-11-(3-nitrophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: O=C1CC(C)(C)CC2=C1C(c1cccc(c1)[N+](=O)[O-])N(C(=O)C)c1c(N2)cccc1

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Molecular Weight: 405.45
Empirical Formula: C23H23N3O4

Physical State: Dry powder
Available Amount: 31 mg

Lipinsky:
logP: 3.574
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 95
Number of rings: 4

     

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