UCSF

ZINC66626305

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 28th, 2011 23 No

Popular Name: N-[(4-methyl-5-sulfanyl-1,2,4-triazol-3-yl)methyl]-5-nitro-1H-indazole-3-carboxamide N-[(4-methyl-5-sulfanyl-1,2,4-tr…

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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) 0.01 4.95 -20.25 3 10 0 137 333.333 4 ↓
Mid Mid (pH 6-8) 0.73 4.7 -49.38 2 10 -1 134 332.325 4 ↓

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

No pre-computed analogs available. Try a structural similarity search.