In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2011 | 19 | Yes |
Popular Name: 6-(aminomethyl)-N-[(1R)-1-(2-fluorophenyl)ethyl]-N-methyl-pyridin-2-amine 6-(aminomethyl)-N-[(1R)-1-(2-flu…
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) | 2.47 | 6.57 | -43.54 | 3 | 3 | 1 | 44 | 260.336 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.47 | 6.5 | -23.94 | 3 | 3 | 1 | 43 | 260.336 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.47 | 6.16 | -7.5 | 2 | 3 | 0 | 42 | 259.328 | 4 | ↓ |