In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 19 | Yes |
Popular Name: (2S)-1-(4-bromophenyl)-N-ethyl-3-(3-pyridyl)propan-2-amine (2S)-1-(4-bromophenyl)-N-ethyl-3…
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) | 3.64 | 9.02 | -48.59 | 2 | 2 | 1 | 29 | 320.254 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.64 | 9.49 | -104.54 | 3 | 2 | 2 | 31 | 321.262 | 6 | ↓ |