In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 14 | Yes |
Popular Name: N-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-4-amine N-[[(1S)-cyclohex-3-en-1-yl]meth…
None
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) | 1.72 | 4.37 | -37.02 | 3 | 2 | 1 | 29 | 195.33 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.72 | 5.5 | -108.39 | 4 | 2 | 2 | 33 | 196.338 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.72 | 4.16 | -38.97 | 3 | 2 | 1 | 29 | 195.33 | 3 | ↓ |