UCSF

ZINC60021692

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2011 25 Yes

Popular Name: 2-hydroxy-6-[2-(4-phenylpiperazin-1-yl)ethylamino]benzoic 2-hydroxy-6-[2-(4-phenylpiperazi…

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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) 2.88 7.26 -71.63 3 6 0 80 341.411 6 ↓
Mid Mid (pH 6-8) 2.88 5.04 -54.26 2 6 -1 79 340.403 6 ↓

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Rings

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

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