In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2009 | 21 | Yes |
Popular Name: 2-[4-[[5-(2-thienyl)-1,2,4-oxadiazol-3-yl]methyl]piperazin-1-yl]acetic 2-[4-[[5-(2-thienyl)-1,2,4-oxadi…
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) | -0.47 | 4.04 | -33.99 | 1 | 7 | 0 | 87 | 308.363 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.47 | 4.11 | -54.22 | 1 | 7 | 0 | 87 | 308.363 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.47 | 1.87 | -47.89 | 0 | 7 | -1 | 86 | 307.355 | 5 | ↓ |