COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK767415
Chemical Name: 4-(4-nitrophenyl)-1,3-diphenyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Smiles: O=C1CSC(c2c(N1)n(nc2c1ccccc1)c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 442.5
Empirical Formula: C24H18N4O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.912
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 118
Number of rings: 5

     

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