In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 5th, 2010 | 26 | Yes |
Popular Name: (2S)-2-(4-chlorophenyl)sulfanyl-N-[5-(o-tolyl)-1,3,4-thiadiazol-2-yl]butanamide (2S)-2-(4-chlorophenyl)sulfanyl-…
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) | 5.75 | 11.34 | -16.6 | 1 | 4 | 0 | 55 | 403.96 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.94 | 9.81 | -45.96 | 0 | 4 | -1 | 61 | 402.952 | 6 | ↓ |