In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 22 | Yes |
Popular Name: 4-[(4S)-1-tert-butyl-6-oxo-5,7-dihydro-4H-pyrazolo[3,4-b]pyridin-4-yl]benzonitrile 4-[(4S)-1-tert-butyl-6-oxo-5,7-d…
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) | 2.44 | 5.68 | -11.6 | 1 | 5 | 0 | 74 | 294.358 | 2 | ↓ |
Ref Reference (pH 7) | 2.25 | 8.15 | -12.49 | 1 | 5 | 0 | 71 | 294.358 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.