In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 13 | Yes |
Popular Name: (1R)-N-ethyl-N-methyl-1-(3-pyridyl)ethane-1,2-diamine (1R)-N-ethyl-N-methyl-1-(3-pyrid…
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) | -0.13 | 1.18 | -46.12 | 3 | 3 | 1 | 44 | 180.275 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.13 | 3.42 | -31.48 | 3 | 3 | 1 | 43 | 180.275 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.13 | 3.17 | -117.88 | 4 | 3 | 2 | 45 | 181.283 | 4 | ↓ |