In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 16 | Yes |
Popular Name: (1R)-N-[(1R)-2-methoxy-1-methyl-ethyl]-N-methyl-1-(3-pyridyl)ethane-1,2-diamine (1R)-N-[(1R)-2-methoxy-1-methyl-…
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) | -0.19 | 0.03 | -45.85 | 3 | 4 | 1 | 53 | 224.328 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.19 | -0.34 | -4.44 | 2 | 4 | 0 | 51 | 223.32 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.19 | 2.52 | -120.73 | 4 | 4 | 2 | 54 | 225.336 | 6 | ↓ |