In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2011 | 17 | Yes |
Popular Name: N-[[(3R)-3-propyl-3-piperidyl]methyl]cyclohexanamine N-[[(3R)-3-propyl-3-piperidyl]me…
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) | 3.35 | 7.32 | -107.82 | 4 | 2 | 2 | 33 | 240.435 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.35 | 5.99 | -36.87 | 3 | 2 | 1 | 29 | 239.427 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.35 | 6.43 | -38.13 | 3 | 2 | 1 | 29 | 239.427 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.