| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2009 | 30 | No |
Popular Name: (E)-3-phenyl-N-[6-[4-(3-pyridylmethyl)piperazin-1-yl]-3-pyridyl]prop-2-enamide (E)-3-phenyl-N-[6-[4-(3-pyridylm…
| 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 | 8.97 | -12.4 | 1 | 6 | 0 | 61 | 399.498 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.89 | 11.18 | -48.58 | 2 | 6 | 1 | 63 | 400.506 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.89 | 9.32 | -38.54 | 2 | 6 | 1 | 63 | 400.506 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.89 | 11.53 | -107.99 | 3 | 6 | 2 | 64 | 401.514 | 6 | ↓ |
