In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 29 | Yes |
Popular Name: 2-[(4S)-spiro[azepane-4,2'-chromene]-1-carbonyl]-1H-quinolin-4-one 2-[(4S)-spiro[azepane-4,2'-chrom…
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) | 3.32 | 10.88 | -14.9 | 1 | 5 | 0 | 62 | 386.451 | 1 | ↓ |
Mid Mid (pH 6-8) | 4.62 | 10.57 | -49.81 | 0 | 5 | -1 | 65 | 385.443 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.