In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 21 | Yes |
Popular Name: (4R)-1-methyl-4-(6-quinolyl)-5,7-dihydro-4H-pyrazolo[3,4-b]pyridin-6-one (4R)-1-methyl-4-(6-quinolyl)-5,7…
None
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) | 1.48 | 3.34 | -13.85 | 1 | 5 | 0 | 63 | 278.315 | 1 | ↓ |
Ref Reference (pH 7) | 1.29 | 5.99 | -15.11 | 1 | 5 | 0 | 60 | 278.315 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.48 | 3.77 | -38.51 | 2 | 5 | 1 | 65 | 279.323 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.29 | 6.42 | -38.88 | 2 | 5 | 1 | 61 | 279.323 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.