| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 16th, 2008 | 24 | Yes |
Popular Name: 2-{4-[(4-methoxyphenyl)methyl]piperazin-1-yl}pyridine-3-carboxylic acid hydrochloride 2-{4-[(4-methoxyphenyl)methyl]pi…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1221724-68-0 , 247117-88-0
| 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) | 2.01 | 8.21 | -50.42 | 1 | 6 | 0 | 70 | 327.384 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.01 | 9.97 | -57.08 | 1 | 6 | 0 | 70 | 327.384 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.01 | 7.74 | -52.13 | 0 | 6 | -1 | 69 | 326.376 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 234 - 236 | Enamine Building Blocks |
| MP | 234...236 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
