| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 19th, 2008 | 35 | Yes |
Popular Name: (2S)-2-[2-cyanoethyl-[(3S)-1-oxo-3-phenyl-isochroman-6-carbonyl]amino]-3-phenyl-propanoic (2S)-2-[2-cyanoethyl-[(3S)-1-oxo…
| 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) | 1.33 | 14.86 | -39.18 | 0 | 7 | -1 | 111 | 467.501 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
