COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053967
Chemical Name: 5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4-{[(E)-(2,4,6-trimethoxyphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: COc1cc(OC)c(c(c1)OC)/C=N/n1c(S)nnc1c1[nH]nc2c1CCC2

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Molecular Weight: 400.46
Empirical Formula: C18H20N6O3S

Physical State: Dry powder
Available Amount: 227 mg

Lipinsky:
logP: 3.068
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 138
Number of rings: 4

     

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