In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2010 | 18 | Yes |
Popular Name: N'-(2-dimethylaminoethyl)-N-methyl-N-(o-tolylmethyl)ethane-1,2-diamine N'-(2-dimethylaminoethyl)-N-meth…
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) | 1.61 | 4.63 | -40.67 | 2 | 3 | 1 | 23 | 250.41 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.61 | 5.25 | -35.49 | 2 | 3 | 1 | 20 | 250.41 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.61 | 7.73 | -87.1 | 3 | 3 | 2 | 21 | 251.418 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.61 | 7.1 | -113.13 | 3 | 3 | 2 | 24 | 251.418 | 8 | ↓ |