In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2008 | 25 | Yes |
Popular Name: N-[3-(4-ethylpiperazin-1-yl)propyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine N-[3-(4-ethylpiperazin-1-yl)prop…
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) | 2.41 | 4.98 | -48.35 | 2 | 7 | 1 | 68 | 346.455 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.41 | 2.67 | -9.09 | 1 | 7 | 0 | 67 | 345.447 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.41 | 4.98 | -41.61 | 2 | 7 | 1 | 68 | 346.455 | 8 | ↓ |