In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 20 | Yes |
Popular Name: [2-(3,5-difluorophenoxy)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]methanamine [2-(3,5-difluorophenoxy)-6,7-dih…
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) | 3.06 | 4.89 | -47.32 | 3 | 3 | 1 | 50 | 277.294 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.06 | 4.43 | -6.01 | 2 | 3 | 0 | 48 | 276.286 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.