In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2008 | 28 | Yes |
Popular Name: 1-(difluoromethyl)-3,5-dimethyl-N-[[4-(morpholinomethyl)phenyl]methyl]pyrazole-4-sulfonamide 1-(difluoromethyl)-3,5-dimethyl-…
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) | 1.43 | 2.89 | -11.99 | 1 | 7 | 0 | 76 | 414.478 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.43 | 2.48 | -40.84 | 0 | 7 | -1 | 79 | 413.47 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.43 | 5.25 | -47.45 | 2 | 7 | 1 | 78 | 415.486 | 7 | ↓ |