COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK570096
Chemical Name: 4-[(E)-({3-[3-(propan-2-yloxy)phenyl]-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl}imino)methyl]benzoicacid
Smiles: CC(Oc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(=O)O)C

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Molecular Weight: 382.44
Empirical Formula: C19H18N4O3S

Physical State: Dry powder
Available Amount: 124 mg

Lipinsky:
logP: 3.566
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 118
Number of rings: 3

     

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