COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK570422
Chemical Name: 1-cycloheptyl-4-(3-nitrophenyl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepine-3,7-diol
Smiles: OC1=Nc2c(C(SC1)c1cccc(c1)[N+](=O)[O-])c(nn2C1CCCCCC1)O

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Molecular Weight: 402.47
Empirical Formula: C19H22N4O4S

Physical State: Dry powder
Available Amount: 11 mg

Lipinsky:
logP: 3.471
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 141
Number of rings: 4

     

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