In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 24th, 2008 | 26 | Yes |
Popular Name: N-[2-[(3,4-difluorophenyl)amino]-2-oxo-ethyl]-2-[methyl-[(1S)-1-phenylethyl]amino]acetamide N-[2-[(3,4-difluorophenyl)amino]…
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) | 3.33 | 7.78 | -45 | 3 | 5 | 1 | 63 | 362.4 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.33 | 5.85 | -13.47 | 2 | 5 | 0 | 61 | 361.392 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.