| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2008 | 24 | Yes |
Popular Name: N,N-dimethyl-N'-(3-pyridylmethyl)-N'-[[3-(trifluoromethyl)phenyl]methyl]ethane-1,2-diamine N,N-dimethyl-N'-(3-pyridylmethyl…
| 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) | 2.81 | 8.71 | -46.6 | 1 | 3 | 1 | 21 | 338.397 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.81 | 6.57 | -6.79 | 0 | 3 | 0 | 19 | 337.389 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.81 | 9.03 | -44.98 | 1 | 3 | 1 | 21 | 338.397 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.81 | 9.5 | -91.61 | 2 | 3 | 2 | 22 | 339.405 | 8 | ↓ |
