In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 18 | Yes |
Popular Name: (1R)-N-benzyl-N-methyl-1-(3-pyridyl)ethane-1,2-diamine (1R)-N-benzyl-N-methyl-1-(3-pyri…
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) | 0.89 | 4.09 | -55.8 | 3 | 3 | 1 | 44 | 242.346 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.89 | 6.06 | -135.45 | 4 | 3 | 2 | 45 | 243.354 | 5 | ↓ |