COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL493954
Chemical Name: 4-(1,5-dimethyl-1H-pyrazol-4-yl)-1-(propan-2-yl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepine-3,7(2H,6H)-dione
Smiles: O=C1CSC(c2c(N1)n([nH]c2=O)C(C)C)c1cnn(c1C)C

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Molecular Weight: 321.4
Empirical Formula: C14H19N5O2S

Physical State: Dry powder
Available Amount: 253 mg

Lipinsky:
logP: 1.613
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 104
Number of rings: 3

     

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