In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 25 | Yes |
Popular Name: 1-(4-ethylpiperazin-1-yl)-3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propan-1-one 1-(4-ethylpiperazin-1-yl)-3-[3-(…
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) | 2.17 | 4.34 | -10.43 | 0 | 7 | 0 | 72 | 344.415 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.17 | 6.56 | -46.44 | 1 | 7 | 1 | 73 | 345.423 | 6 | ↓ |