| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 19 | Yes |
Popular Name: 2-[[3-(4-methylpiperazin-1-yl)propylamino]methyl]phenol 2-[[3-(4-methylpiperazin-1-yl)pr…
| 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) | 1.63 | 4.1 | -87.09 | 4 | 4 | 2 | 45 | 265.401 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.63 | 2.41 | -34.88 | 2 | 4 | 0 | 46 | 263.385 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.63 | 3.97 | -105.95 | 4 | 4 | 2 | 45 | 265.401 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.63 | 1.63 | -40.14 | 3 | 4 | 1 | 43 | 264.393 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
