| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 17 | Yes |
Popular Name: 5-Fluoro-2-(4-methylpiperazin-1-yl)benzoic acid 5-Fluoro-2-(4-methylpiperazin-1-…
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CAS Numbers: 1096829-46-7 , 1269152-68-2
5-Fluoro-2-(4-methyl-1-piperazinyl)benzoic acid
5-Fluoro-2-(4-methyl-1-piperazinyl)benzoicAcid
5-fluoro-2-(4-methylpiperazin-1-yl)benzoic acid dihydrochloride
| 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) | 2.12 | 8.36 | -60.96 | 1 | 4 | 0 | 48 | 238.262 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.12 | 5.99 | -49.78 | 0 | 4 | -1 | 47 | 237.254 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 205 - 207 | Enamine Building Blocks |
| MP | 205...207 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
