In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2011 | 27 | Yes |
Popular Name: 2-[benzyl(isopropyl)amino]-N-[2-(3,4-difluoroanilino)-2-oxo-ethyl]acetamide 2-[benzyl(isopropyl)amino]-N-[2-…
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) | 3.45 | 7.77 | -44.39 | 3 | 5 | 1 | 63 | 376.427 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.45 | 6.09 | -13.59 | 2 | 5 | 0 | 61 | 375.419 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.