| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2011 | 17 | Yes |
Popular Name: (1R,3S)-3-methoxy-N-[[(2R)-1-methyl-2-piperidyl]methyl]cyclohexanamine (1R,3S)-3-methoxy-N-[[(2R)-1-met…
| 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) | 2.16 | 6.64 | -112.22 | 3 | 3 | 2 | 30 | 242.407 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.16 | 6 | -32.73 | 2 | 3 | 1 | 26 | 241.399 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.16 | 5.08 | -36.19 | 2 | 3 | 1 | 29 | 241.399 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
