In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 30th, 2011 | 21 | Yes |
Popular Name: N-[(1R)-2-(5-bromo-2-fluoro-phenyl)-1-(3-methyl-2-pyridyl)ethyl]propan-1-amine N-[(1R)-2-(5-bromo-2-fluoro-phen…
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) | 4.88 | 9.75 | -31.06 | 2 | 2 | 1 | 29 | 352.271 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.88 | 8.78 | -3.28 | 1 | 2 | 0 | 25 | 351.263 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.88 | 9.16 | -31.87 | 2 | 2 | 1 | 26 | 352.271 | 6 | ↓ |