In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 16 | Yes |
Popular Name: (2R,4R)-4-(1-methylimidazol-2-yl)-2-propyl-tetrahydropyran-4-ol (2R,4R)-4-(1-methylimidazol-2-yl…
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) | 1.31 | 4.12 | -30.84 | 2 | 4 | 1 | 49 | 225.312 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.31 | 3.7 | -6.44 | 1 | 4 | 0 | 47 | 224.304 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.