UCSF

ZINC44379603

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 24th, 2010 26 No

Popular Name: 2-(3,4-dimethylphenoxy)-N-[4-methyl-5-(4-methyl-5-thioxo-1H-1,2,4-triazol-3-yl)thiazol-2-yl]acetamid 2-(3,4-dimethylphenoxy)-N-[4-met…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.37 10.07 -55.91 1 7 -1 82 388.498 5 ↓
Hi High (pH 8-9.5) 3.56 7.71 -93.26 0 7 -2 88 387.49 5 ↓
Lo Low (pH 4.5-6) 2.65 9.99 -23.6 2 7 0 85 389.506 5 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )