In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 3rd, 2010 | 16 | Yes |
Popular Name: 3-Fluoro-4-piperazinobenzoic acid 3-Fluoro-4-piperazinobenzoic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1197193-04-6 , 3829-80-9
3-Fluoro-4-(piperazin-1-yl)benzoic acid
3-Fluoro-4-piperazinobenzoicAcid
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) | 1.34 | 5.56 | -77.63 | 2 | 4 | 0 | 60 | 224.235 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.34 | 4.26 | -44.77 | 1 | 4 | -1 | 55 | 223.227 | 2 | ↓ |