UCSF

ZINC60220668

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 17th, 2011 15 No

Popular Name: 5-(1H-indol-3-yl)-1,2,4-triazole-3-thione 5-(1H-indol-3-yl)-1,2,4-triazole…

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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) 2.37 5.48 -49.51 2 4 -1 57 215.261 1 ↓
Mid Mid (pH 6-8) 2.37 5.51 -24.72 3 4 0 59 216.269 1 ↓

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

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