COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK092288
Chemical Name: 10-acetyl-11-(4-nitrophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: O=C1CCCC2=C1C(c1ccc(cc1)[N+](=O)[O-])N(C(=O)C)c1c(N2)cccc1

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Molecular Weight: 377.4
Empirical Formula: C21H19N3O4

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 2.541
Rotatable bonds: 0
H-donors: 1
H-acceptors: 4
PSA: 95
Number of rings: 4

     

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