In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 14th, 2009 | 22 | Yes |
Popular Name: (2S)-2-(2,3-dimethylphenoxy)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)propanamide (2S)-2-(2,3-dimethylphenoxy)-N-(…
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) | 3.78 | 8.43 | -20.35 | 1 | 5 | 0 | 64 | 337.47 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.96 | 7.34 | -46.32 | 0 | 5 | -1 | 70 | 336.462 | 6 | ↓ |