UCSF

ZINC04244933

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2005 15 Yes

Popular Name: 3-(Piperazin-1-yl)benzoic acid 3-(Piperazin-1-yl)benzoic acid

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CAS Numbers: 1187931-15-2 , 446831-28-3

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) 1.22 2.97 -82.71 2 4 0 60 206.245 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Purity 96% Fluorochem
MP >220° Oakwood Chemical

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