UCSF

ZINC67740683

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 14th, 2011 24 Yes

Popular Name: 1-[[(3S)-1-furo[3,2-c]pyridin-4-yl-3-piperidyl]methyl]triazole-4-carboxylic 1-[[(3S)-1-furo[3,2-c]pyridin-4-…

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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) 1.52 7.1 -57.47 0 8 -1 100 326.336 4 ↓
Mid Mid (pH 6-8) 1.52 7.57 -69.45 1 8 0 101 327.344 4 ↓

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

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