COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK236345
Chemical Name: 1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-[(5-nitro-1H-benzimidazol-2-yl)sulfanyl]ethanone
Smiles: O=C(N1c2ccccc2CCc2c1cccc2)CSc1nc2c([nH]1)ccc(c2)[N+](=O)[O-]

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Molecular Weight: 430.49
Empirical Formula: C23H18N4O3S

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 5.997
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 120
Number of rings: 5

     

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