| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 31st, 2010 | 27 | Yes |
Popular Name: 3,3-dimethyl-N-[4-[[4-(2-pyridyl)piperazin-1-yl]methyl]phenyl]butanamide 3,3-dimethyl-N-[4-[[4-(2-pyridyl…
| 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) | 3.58 | 9.48 | -32.95 | 2 | 5 | 1 | 50 | 367.517 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.58 | 9.15 | -9.68 | 1 | 5 | 0 | 48 | 366.509 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.58 | 11.7 | -97.61 | 3 | 5 | 2 | 51 | 368.525 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.58 | 11.38 | -43.25 | 2 | 5 | 1 | 50 | 367.517 | 6 | ↓ |
