In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 5th, 2010 | 26 | Yes |
Popular Name: (2S)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-2-(p-tolylsulfanyl)butanamide (2S)-N-[5-(4-fluorophenyl)-1,3,4…
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) | 5.29 | 10.95 | -16.09 | 1 | 4 | 0 | 55 | 387.505 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.47 | 9.18 | -45.89 | 0 | 4 | -1 | 61 | 386.497 | 6 | ↓ |