In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2011 | 22 | Yes |
Popular Name: 2-cyclohexyl-4-[(1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methyl]thiazole 2-cyclohexyl-4-[(1-methyl-6,7-di…
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) | 1.66 | 9.12 | -30.35 | 1 | 4 | 1 | 35 | 317.482 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.66 | 8.66 | -12.68 | 0 | 4 | 0 | 34 | 316.474 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.66 | 11.38 | -93.23 | 2 | 4 | 2 | 36 | 318.49 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.