| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2011 | 19 | Yes |
Popular Name: N,4-dimethyl-N-[[(3S)-3-propyl-3-piperidyl]methyl]cyclohexanamine N,4-dimethyl-N-[[(3S)-3-propyl-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) | 3.37 | 9.48 | -105.23 | 3 | 2 | 2 | 21 | 268.489 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.37 | 7.56 | -36.13 | 2 | 2 | 1 | 20 | 267.481 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.37 | 8.18 | -33.2 | 2 | 2 | 1 | 16 | 267.481 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
