COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK407840
Chemical Name: 7,8-dimethyl-11-(4-methyl-3-nitrophenyl)-3-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: O=C1CC(CC2=C1C(Nc1c(N2)cc(c(c1)C)C)c1ccc(c(c1)[N+](=O)[O-])C)c1cccs1

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Molecular Weight: 459.57
Empirical Formula: C26H25N3O3S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 4.831
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 115
Number of rings: 5

     

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