In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2011 | 25 | Yes |
Popular Name: 2-[3-(2-isopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)propyl]-1,3-benzoxazole 2-[3-(2-isopropyl-1-methyl-6,7-d…
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) | 3.57 | 7.38 | -30.94 | 1 | 5 | 1 | 48 | 339.463 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.57 | 9.03 | -48.04 | 1 | 5 | 1 | 48 | 339.463 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.