In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 30th, 2011 | 21 | Yes |
Popular Name: (2S)-1-(2-chloro-4-fluoro-phenyl)-N-propyl-3-(3-pyridyl)propan-2-amine (2S)-1-(2-chloro-4-fluoro-phenyl…
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) | 4.11 | 9.62 | -50.22 | 2 | 2 | 1 | 29 | 307.82 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.11 | 10.09 | -104.04 | 3 | 2 | 2 | 31 | 308.828 | 7 | ↓ |