In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 15 | Yes |
Popular Name: 4-fluoro-3-[[[(1S,2S)-2-methylcyclopropyl]amino]methyl]benzonitrile 4-fluoro-3-[[[(1S,2S)-2-methylcy…
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) | 2.32 | 7.08 | -41.61 | 2 | 2 | 1 | 40 | 205.256 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.32 | 5.78 | -4.56 | 1 | 2 | 0 | 36 | 204.248 | 3 | ↓ |