In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2011 | 24 | Yes |
Popular Name: 4-(dimethylaminomethyl)-N-[[2-(dimethylaminomethyl)phenyl]methyl]benzamide 4-(dimethylaminomethyl)-N-[[2-(d…
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) | 2.09 | 11.31 | -89.52 | 3 | 4 | 2 | 38 | 327.472 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.09 | 8.15 | -38.04 | 2 | 4 | 1 | 37 | 326.464 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.09 | 6.66 | -6.83 | 1 | 4 | 0 | 36 | 325.456 | 7 | ↓ |