In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 20 | Yes |
Popular Name: (2S)-1-(3-bromophenyl)-N-propyl-3-(4-pyridyl)propan-2-amine (2S)-1-(3-bromophenyl)-N-propyl-…
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) | 4.07 | 9.77 | -50.09 | 2 | 2 | 1 | 29 | 334.281 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.07 | 10.23 | -102.05 | 3 | 2 | 2 | 31 | 335.289 | 7 | ↓ |