In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 13th, 2008 | 34 | Yes |
Popular Name: 1-[(3S)-1-oxo-3-phenyl-isochroman-6-carbonyl]-4-phenyl-piperidine-4-carboxylic 1-[(3S)-1-oxo-3-phenyl-isochroma…
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) | 3.60 | 13.8 | -51.61 | 0 | 6 | -1 | 87 | 454.502 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.