| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 19 | Yes |
Popular Name: 4-[[3-(4-methylpiperazin-1-yl)propylamino]methyl]phenol 4-[[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) | 1.21 | 3.97 | -93.89 | 4 | 4 | 2 | 45 | 265.401 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.21 | 2.3 | -67.92 | 2 | 4 | 0 | 46 | 263.385 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.21 | 3.84 | -113.78 | 4 | 4 | 2 | 45 | 265.401 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.21 | 1.51 | -46.73 | 3 | 4 | 1 | 43 | 264.393 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
