In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 16 | Yes |
Popular Name: (3R)-3-(4-ethyl-5-propyl-1H-imidazol-2-yl)piperidine (3R)-3-(4-ethyl-5-propyl-1H-imid…
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) | 1.93 | 6.06 | -42.19 | 3 | 3 | 1 | 45 | 222.356 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.93 | 6.44 | -95.71 | 4 | 3 | 2 | 47 | 223.364 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.93 | 5.89 | -42.25 | 3 | 3 | 1 | 45 | 222.356 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.