In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 18 | Yes |
Popular Name: (1R)-N-[(3-chloro-4-fluoro-phenyl)methyl]-1-(4-pyridyl)ethanamine (1R)-N-[(3-chloro-4-fluoro-pheny…
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) | 2.94 | 7.67 | -54.68 | 2 | 2 | 1 | 29 | 265.739 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.94 | 6.55 | -7.32 | 1 | 2 | 0 | 25 | 264.731 | 4 | ↓ |