| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 21 | Yes |
Popular Name: 1-[4-(3-aminopropyl)piperazin-1-yl]-3-(p-tolyl)propan-1-one 1-[4-(3-aminopropyl)piperazin-1-…
| 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) | 1.40 | 5.33 | -49.21 | 3 | 4 | 1 | 51 | 290.431 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.40 | 7.54 | -116.82 | 4 | 4 | 2 | 52 | 291.439 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
