In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 30th, 2006 | 25 | No |
Popular Name: N-[2-(difluoromethylsulfanyl)phenyl]-2-(ethyl-(tert-butylcarbamoylmethyl)amino)-acetamide N-[2-(difluoromethylsulfanyl)phe…
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) | 3.62 | 7.53 | -42.43 | 3 | 5 | 1 | 63 | 374.477 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.62 | 5.51 | -13.75 | 2 | 5 | 0 | 61 | 373.469 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.44 | 6.58 | -31.29 | 2 | 5 | 0 | 69 | 373.469 | 9 | ↓ |