In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 18 | Yes |
Popular Name: (2S)-2-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]thio]propionic-acid-methyl-ester (2S)-2-[[5-(4-pyridyl)-1,3,4-oxa…
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) | 1.47 | 1.58 | -7.95 | 0 | 6 | 0 | 78 | 265.294 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.47 | 2.05 | -42.44 | 1 | 6 | 1 | 79 | 266.302 | 5 | ↓ |