| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 21 | Yes |
Popular Name: 3-(4-methylpiperazin-1-yl)-N-[(2,4,6-trimethylphenyl)methyl]propan-1-amine 3-(4-methylpiperazin-1-yl)-N-[(2…
| 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) | 2.89 | 8.62 | -91.46 | 3 | 3 | 2 | 24 | 291.483 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.89 | 8.49 | -112.64 | 3 | 3 | 2 | 24 | 291.483 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.89 | 6.16 | -43.02 | 2 | 3 | 1 | 23 | 290.475 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
