In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 17 | Yes |
Popular Name: (1R)-N-ethyl-N-[(1R)-2-methoxy-1-methyl-ethyl]-1-(3-pyridyl)ethane-1,2-diamine (1R)-N-ethyl-N-[(1R)-2-methoxy-1…
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) | 0.18 | 1.33 | -42.79 | 3 | 4 | 1 | 53 | 238.355 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.18 | 1.5 | -3.78 | 2 | 4 | 0 | 51 | 237.347 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.18 | 3.69 | -29.31 | 3 | 4 | 1 | 53 | 238.355 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.18 | 3.5 | -117.16 | 4 | 4 | 2 | 54 | 239.363 | 7 | ↓ |