In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2011 | 24 | Yes |
Popular Name: 3-[(2R)-3-[benzyl(methyl)amino]-2-hydroxy-propyl]-5-(2-thienyl)-1,3,4-oxadiazol-2-one 3-[(2R)-3-[benzyl(methyl)amino]-…
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) | 1.89 | 5.05 | -44.81 | 2 | 6 | 1 | 73 | 346.432 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.89 | 2.71 | -11.16 | 1 | 6 | 0 | 72 | 345.424 | 7 | ↓ |