UCSF

ZINC41786409

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 22nd, 2010 16 Yes

Popular Name: 3-isobutyl-5-(4H-1,2,4-triazol-3-ylsulfanylmethyl)-1,2,4-oxadiazole 3-isobutyl-5-(4H-1,2,4-triazol-3…

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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) 1.30 3.87 -7.74 1 6 0 80 239.304 5 ↓
Hi High (pH 8-9.5) 1.30 3.82 -36.78 0 6 -1 79 238.296 5 ↓

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

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