In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 19 | Yes |
Popular Name: (1S)-1-(5-bromo-3-pyridyl)-1-(5-fluoro-2-methoxy-phenyl)-N-methyl-methanamine (1S)-1-(5-bromo-3-pyridyl)-1-(5-…
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) | 3.14 | 6.43 | -43.99 | 2 | 3 | 1 | 39 | 326.189 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.14 | 5.47 | -4.39 | 1 | 3 | 0 | 34 | 325.181 | 4 | ↓ |