In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 27th, 2010 | 34 | Yes |
Popular Name: N-[(1S,2R)-2-benzyl-3-oxo-1,4-diphenyl-butyl]-2-hydroxy-benzamide N-[(1S,2R)-2-benzyl-3-oxo-1,4-di…
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) | 6.35 | 14.41 | -17.1 | 2 | 4 | 0 | 66 | 449.55 | 9 | ↓ |
Hi High (pH 8-9.5) | 6.35 | 15.42 | -60.8 | 1 | 4 | -1 | 69 | 448.542 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.