UCSF

ZINC41648568

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 21 Yes

Popular Name: 2-Methyl-6-(4-phenyl-piperazin-1-ylmethyl)-3H-pyrimidin-4-one 2-Methyl-6-(4-phenyl-piperazin-1…

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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) 1.40 7.59 -46.36 2 5 1 53 285.371 3 ↓
Mid Mid (pH 6-8) 1.40 5.35 -11.54 1 5 0 52 284.363 3 ↓
Mid Mid (pH 6-8) 1.85 5.24 -53.26 1 5 0 57 284.363 3 ↓

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

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