In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 18 | Yes |
Popular Name: (5S)-8-isopropyl-3,3-dimethyl-6-oxo-4,5-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile (5S)-8-isopropyl-3,3-dimethyl-6-…
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) | 2.03 | 4.2 | -12.86 | 0 | 4 | 0 | 62 | 246.31 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.