In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 13th, 2008 | 32 | Yes |
Popular Name: (3S)-3-(4-fluorophenyl)-3-[[(3R)-1-oxo-3-phenyl-isochroman-6-carbonyl]amino]propanoic (3S)-3-(4-fluorophenyl)-3-[[(3R)…
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) | 2.87 | 11.77 | -54.46 | 1 | 6 | -1 | 96 | 432.427 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.