In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 19 | Yes |
Popular Name: 5-(2-methoxy-5-methyl-phenyl)-2-[(2R)-pyrrolidin-2-yl]-1H-imidazole 5-(2-methoxy-5-methyl-phenyl)-2-…
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) | 2.28 | 5.91 | -36.88 | 3 | 4 | 1 | 55 | 258.345 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.28 | 4.58 | -9.05 | 2 | 4 | 0 | 50 | 257.337 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.28 | 6.34 | -103.11 | 4 | 4 | 2 | 56 | 259.353 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.