UCSF

ZINC49352406

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 27th, 2010 19 Yes

Popular Name: [4-(3-methyl-1,2,4-oxadiazol-5-yl)-1-piperidyl]-(1H-triazol-4-yl)methanone [4-(3-methyl-1,2,4-oxadiazol-5-y…

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Download: MOL2 SDF SMILES Flexibase

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) -0.46 1.09 -11.81 1 8 0 101 262.273 2 ↓
Hi High (pH 8-9.5) -0.46 1.07 -39.47 0 8 -1 99 261.265 2 ↓

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Rings

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

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