In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2013 | 18 | Yes |
Popular Name: Methyl5-Fluoro-2-(4-methylpiperazino)benzoate Methyl5-Fluoro-2-(4-methylpipera…
Find On: PubMed — Wikipedia — Google
CAS Number: 105-13-5
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) | 2.37 | 8.45 | -37.39 | 1 | 4 | 1 | 34 | 253.297 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.37 | 6.07 | -5.29 | 0 | 4 | 0 | 33 | 252.289 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.