In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 18th, 2008 | 24 | Yes |
Popular Name: (2S)-4-[[4-(difluoromethoxy)phenyl]amino]-4-oxo-2-piperazin-1-yl-butanoic (2S)-4-[[4-(difluoromethoxy)phen…
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) | 0.33 | 4.58 | -42.24 | 3 | 7 | 0 | 95 | 343.33 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.33 | 5.78 | -106.04 | 4 | 7 | 1 | 100 | 344.338 | 7 | ↓ |