In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 17 | Yes |
Popular Name: (3S)-1-[(1R,2R,5S)-2-(aminomethyl)-5-ethyl-cyclohexyl]piperidin-3-ol (3S)-1-[(1R,2R,5S)-2-(aminomethy…
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) | 1.37 | 3.38 | -107.96 | 5 | 3 | 2 | 52 | 242.407 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.