In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 14th, 2008 | 20 | No |
Popular Name: 5-(3,5-dimethylphenyl)-3-(pyrrolidin-1-ylmethyl)-1,3,4-oxadiazole-2-thione 5-(3,5-dimethylphenyl)-3-(pyrrol…
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) | 2.91 | 7.71 | -35.48 | 1 | 4 | 1 | 35 | 290.412 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.91 | 5.09 | -7.68 | 0 | 4 | 0 | 34 | 289.404 | 3 | ↓ |