In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 21 | Yes |
Popular Name: 3-[[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]methyl]-5-propyl-1,2,4-oxadiazole 3-[[(3R)-3-ethyl-4-(2-methoxyeth…
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) | 1.64 | 4.1 | -35.07 | 1 | 6 | 1 | 56 | 297.423 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 1.95 | -7.18 | 0 | 6 | 0 | 55 | 296.415 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 4.71 | -34.27 | 1 | 6 | 1 | 56 | 297.423 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.