COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL369942
Chemical Name: 4-{[5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-3-nitrobenzaldehyde
Smiles: O=Cc1ccc(c(c1)[N+](=O)[O-])Sc1nnc([nH]1)c1ccc(cc1Cl)Cl

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Molecular Weight: 395.23
Empirical Formula: C15H8Cl2N4O3S

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 5.537
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 129
Number of rings: 3

     

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