In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 31 | Yes |
Popular Name: 4-[[4-(3,4-dimethylphenyl)piperazin-1-yl]methyl]-N-(2-pyridylmethyl)benzamide 4-[[4-(3,4-dimethylphenyl)pipera…
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 | 9.59 | -11.46 | 1 | 5 | 0 | 48 | 414.553 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.58 | 11.82 | -51.72 | 2 | 5 | 1 | 50 | 415.561 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.58 | 12.23 | -93.38 | 3 | 5 | 2 | 51 | 416.569 | 6 | ↓ |