In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 24th, 2011 | 25 | Yes |
Popular Name: [4-(dimethylaminomethyl)phenyl]-[4-(m-tolyl)piperazin-1-yl]methanone [4-(dimethylaminomethyl)phenyl]-…
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) | 2.72 | 11.06 | -47.1 | 1 | 4 | 1 | 28 | 338.475 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.72 | 8.59 | -8.64 | 0 | 4 | 0 | 27 | 337.467 | 4 | ↓ |