| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 21 | Yes |
Popular Name: (2S)-1-[[(1R,2S,4S)-2,4-dimethylcyclohexyl]amino]-3-(2-methylphenoxy)propan-2-ol (2S)-1-[[(1R,2S,4S)-2,4-dimethyl…
| 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) | 3.69 | 7.24 | -41.41 | 3 | 3 | 1 | 46 | 292.443 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.69 | 6.36 | -4.59 | 2 | 3 | 0 | 41 | 291.435 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
