In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2010 | 19 | Yes |
Popular Name: 2-[4-[(5-propyl-1,2,4-oxadiazol-3-yl)methyl]piperazin-1-yl]acetic 2-[4-[(5-propyl-1,2,4-oxadiazol-…
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) | -0.88 | 3.56 | -33.55 | 1 | 7 | 0 | 87 | 268.317 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.88 | 3.63 | -53.78 | 1 | 7 | 0 | 87 | 268.317 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.88 | 1.37 | -46.83 | 0 | 7 | -1 | 86 | 267.309 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.