In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2008 | 25 | No |
Popular Name: (2S)-2-[[2-[(2-chlorophenyl)amino]-2-oxo-ethyl]-methyl-amino]-N-(2-fluorophenyl)propanamide (2S)-2-[[2-[(2-chlorophenyl)amin…
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) | 3.39 | 8.22 | -39.66 | 3 | 5 | 1 | 63 | 364.828 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.21 | 7.36 | -36.37 | 2 | 5 | 0 | 69 | 363.82 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.21 | 5.06 | -47.05 | 1 | 5 | -1 | 68 | 362.812 | 6 | ↓ |