In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 35 | Yes |
Popular Name: N-[2-(4-ethylpiperazin-1-yl)ethyl]-2,3-diphenyl-quinoxaline-6-carboxamide N-[2-(4-ethylpiperazin-1-yl)ethy…
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) | 4.55 | 10.14 | -45.81 | 2 | 6 | 1 | 63 | 466.609 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.62 | 5.21 | -9.48 | 1 | 6 | 0 | 65 | 465.601 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.62 | 7.49 | -38.66 | 2 | 6 | 1 | 66 | 466.609 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.55 | 7.87 | -14.39 | 1 | 6 | 0 | 61 | 465.601 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.62 | 8.86 | -91.87 | 3 | 6 | 2 | 68 | 467.617 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.55 | 10.14 | -51.61 | 2 | 6 | 1 | 63 | 466.609 | 7 | ↓ |