In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 15 | Yes |
Popular Name: 4-ethyl-5-propyl-2-[(2S)-pyrrolidin-2-yl]-1H-imidazole 4-ethyl-5-propyl-2-[(2S)-pyrroli…
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) | 2.27 | 5.58 | -34.7 | 3 | 3 | 1 | 45 | 208.329 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.27 | 4.58 | -23.6 | 3 | 3 | 1 | 42 | 208.329 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.27 | 5.92 | -99.76 | 4 | 3 | 2 | 47 | 209.337 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.