| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 16 | Yes |
Popular Name: (S)-(2-fluorophenyl)-[(1R,3R)-3-methylcyclohexyl]methanamine (S)-(2-fluorophenyl)-[(1R,3R)-3-…
| 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) | 1.84 | 6.98 | -46.27 | 3 | 1 | 1 | 28 | 222.327 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.84 | 6.7 | -2.82 | 2 | 1 | 0 | 26 | 221.319 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
