UCSF

ZINC60965831

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 3rd, 2011 21 Yes

Popular Name: 2-(4-hydroxy-6-propyl-pyrimidin-2-yl)sulfanyl-1-[(3R)-3-methyl-1-piperidyl]ethanone 2-(4-hydroxy-6-propyl-pyrimidin-…

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Download: MOL2 SDF SMILES Flexibase

Annotations

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Vendors

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) 2.95 6.9 -11.95 1 5 0 66 309.435 5 ↓
Mid Mid (pH 6-8) 3.41 4.96 -46.13 0 5 -1 69 308.427 5 ↓

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

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