In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2010 | 22 | Yes |
Popular Name: (2S)-4-[3-(3,4-difluoroanilino)-3-oxo-propyl]morpholine-2-carboxamide (2S)-4-[3-(3,4-difluoroanilino)-…
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) | 0.24 | 0.69 | -18 | 3 | 6 | 0 | 85 | 313.304 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.24 | 2.95 | -63.34 | 4 | 6 | 1 | 86 | 314.312 | 5 | ↓ |