COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL051271
Chemical Name: 4-({(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene}amino)-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1cc(ccc1OCc1ccccc1)/C=N/n1c(S)nnc1c1[nH]nc2c1CCC2

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Molecular Weight: 446.53
Empirical Formula: C23H22N6O2S

Physical State: Dry powder
Available Amount: 226 mg

Lipinsky:
logP: 5.624
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 129
Number of rings: 5

     

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