In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2010 | 15 | Yes |
Popular Name: (3R)-1-[(1-ethylimidazol-2-yl)methyl]piperidin-3-amine (3R)-1-[(1-ethylimidazol-2-yl)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) | -0.46 | 3.05 | -87.31 | 4 | 4 | 2 | 50 | 210.325 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.46 | 2.6 | -50.16 | 3 | 4 | 1 | 49 | 209.317 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.