In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 2009 | 19 | Yes |
Popular Name: N-[(1R)-2-(3-fluorophenyl)-1-(2-pyridyl)ethyl]propan-1-amine N-[(1R)-2-(3-fluorophenyl)-1-(2-…
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) | 3.33 | 9 | -35.56 | 2 | 2 | 1 | 29 | 259.348 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.33 | 7.63 | -3.84 | 1 | 2 | 0 | 25 | 258.34 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.33 | 8.99 | -111.45 | 3 | 2 | 2 | 31 | 260.356 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.33 | 8.06 | -35.56 | 2 | 2 | 1 | 26 | 259.348 | 6 | ↓ |