In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 21 | Yes |
Popular Name: 3-(1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(5-methylisoxazol-3-yl)propanamide 3-(1-methyl-6,7-dihydro-4H-imida…
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) | -0.62 | 5.7 | -40.2 | 2 | 7 | 1 | 77 | 290.347 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.62 | 5.23 | -14.35 | 1 | 7 | 0 | 76 | 289.339 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.62 | 7.45 | -50.61 | 2 | 7 | 1 | 77 | 290.347 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.