UCSF

ZINC20240489

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2008 36 No

Popular Name: 4-[(4-benzylpiperazin-1-yl)methyl]-N-(cyclododecylideneamino)benzamide 4-[(4-benzylpiperazin-1-yl)methy…

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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) 7.08 15.61 -49.61 2 5 1 49 489.728 6 ↓
Mid Mid (pH 6-8) 7.08 15.61 -52.54 2 5 1 49 489.728 6 ↓
Mid Mid (pH 6-8) 7.08 13.35 -13.25 1 5 0 48 488.72 6 ↓

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

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