UCSF

ZINC13282342

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 14th, 2008 15 Yes

Popular Name: 5-(1H-imidazol-2-ylsulfanylmethyl)-1H-pyrimidine-2,4-dione 5-(1H-imidazol-2-ylsulfanylmethy…

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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) -0.41 0.5 -17.51 3 6 0 94 224.245 3 ↓
Mid Mid (pH 6-8) -0.41 0.95 -43.87 4 6 1 96 225.253 3 ↓

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

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