| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 1st, 2009 | 24 | Yes |
Popular Name: 3-[4-(m-tolylmethyl)piperazine-1-carbonyl]benzonitrile 3-[4-(m-tolylmethyl)piperazine-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) | 2.35 | 8.7 | -12.01 | 0 | 4 | 0 | 47 | 319.408 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.35 | 10.97 | -53.08 | 1 | 4 | 1 | 49 | 320.416 | 3 | ↓ |
