In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 25 | Yes |
Popular Name: (2S)-1-indolin-1-yl-2-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propan-1-one (2S)-1-indolin-1-yl-2-[[5-(4-pyr…
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) | 2.64 | 4.98 | -12.16 | 0 | 6 | 0 | 72 | 352.419 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.64 | 5.44 | -49.05 | 1 | 6 | 1 | 73 | 353.427 | 4 | ↓ |