In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2008 | 26 | Yes |
Popular Name: (2S)-N-benzyl-N-ethyl-2-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide (2S)-N-benzyl-N-ethyl-2-[[5-(4-p…
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) | 2.73 | 5.79 | -10.66 | 0 | 6 | 0 | 72 | 368.462 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.73 | 6.27 | -44.64 | 1 | 6 | 1 | 73 | 369.47 | 7 | ↓ |