In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 20 | Yes |
Popular Name: (2S)-1-(5-bromo-2-methoxy-phenyl)-N-methyl-3-(4-pyridyl)propan-2-amine (2S)-1-(5-bromo-2-methoxy-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) | 3.20 | 7.52 | -45.36 | 2 | 3 | 1 | 39 | 336.253 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.20 | 7.98 | -95.81 | 3 | 3 | 2 | 40 | 337.261 | 6 | ↓ |