UCSF

ZINC65496702

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 27 Yes

Popular Name: 5-[3-[[(2R)-1,4-dioxan-2-yl]methyl]-5-phenyl-imidazol-4-yl]-2-propyl-pyrimidine 5-[3-[[(2R)-1,4-dioxan-2-yl]meth…

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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) 2.35 9.99 -11.03 0 6 0 62 364.449 6 ↓
Mid Mid (pH 6-8) 2.35 10.55 -41.26 1 6 1 63 365.457 6 ↓

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

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