| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2010 | 20 | Yes |
Popular Name: (1S,3R)-3-methyl-N-[2-[(3S)-3-(trifluoromethyl)-1-piperidyl]ethyl]cyclohexanamine (1S,3R)-3-methyl-N-[2-[(3S)-3-(t…
| 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) | 3.74 | 7.08 | -41.02 | 2 | 2 | 1 | 20 | 293.397 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.74 | 9.31 | -124.82 | 3 | 2 | 2 | 21 | 294.405 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
