UCSF

ZINC55568575

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 16th, 2010 20 Yes

Popular Name: 1-[(5-oxothiazolo[3,2-a]pyrimidin-7-yl)methyl]piperidine-4-carboxamide 1-[(5-oxothiazolo[3,2-a]pyrimidi…

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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) 0.34 2.31 -39.44 3 6 1 82 293.372 3 ↓
Hi High (pH 8-9.5) 0.34 2.34 -17.68 2 6 0 81 292.364 3 ↓

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

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