UCSF

ZINC53363922

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2010 34 No

Popular Name: 2-[(2S,4S)-6-(1,3-benzodioxol-5-yl)-2-(3-bromo-4-methoxy-phenyl)-1,2,3,4-tetrahydropyrimidin-4-yl]-6 2-[(2S,4S)-6-(1,3-benzodioxol-5-…

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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) 4.61 7.14 -12.34 2 7 0 82 525.399 6 ↓
Mid Mid (pH 6-8) 4.61 8.17 -54.92 3 7 1 86 526.407 6 ↓

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

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