In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 20 | Yes |
Popular Name: 4-[(1-isopropylpyrazolo[3,4-b]pyridin-5-yl)amino]-4-oxo-butanoic 4-[(1-isopropylpyrazolo[3,4-b]py…
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) | 0.65 | 5.62 | -48.02 | 1 | 7 | -1 | 100 | 275.288 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.65 | 3.64 | -13.38 | 2 | 7 | 0 | 97 | 276.296 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.