UCSF

ZINC41584958

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 34 Yes

Popular Name: 8-[(4-benzylpiperazin-1-yl)methyl]-7-hydroxy-3-(2-methoxyphenyl)chromen-4-one 8-[(4-benzylpiperazin-1-yl)methy…

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Download: MOL2 SDF SMILES Flexibase

Annotations

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Vendors

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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) 4.54 9.83 -47.58 2 6 1 67 457.55 6 ↓
Mid Mid (pH 6-8) 4.54 7.56 -13.2 1 6 0 66 456.542 6 ↓
Mid Mid (pH 6-8) 4.54 9.81 -46.7 2 6 1 67 457.55 6 ↓

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