In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 5th, 2010 | 27 | Yes |
Popular Name: (2S)-2-(p-tolylsulfanyl)-N-[5-(2,4,6-trimethylphenyl)-1,3,4-thiadiazol-2-yl]propanamide (2S)-2-(p-tolylsulfanyl)-N-[5-(2…
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) | 5.82 | 11.96 | -17.19 | 1 | 4 | 0 | 55 | 397.569 | 5 | ↓ |
Hi High (pH 8-9.5) | 6.01 | 10.41 | -51.98 | 0 | 4 | -1 | 61 | 396.561 | 5 | ↓ |