In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2009 | 33 | Yes |
Popular Name: 3-(aminomethyl)-N-[3-(3,5-dimethoxyanilino)quinoxalin-2-yl]benzenesulfonamide 3-(aminomethyl)-N-[3-(3,5-dimeth…
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) | 3.94 | 4.75 | -81.49 | 4 | 9 | 0 | 132 | 465.535 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.94 | 4.35 | -55.61 | 3 | 9 | -1 | 131 | 464.527 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.94 | 5.29 | -61.79 | 5 | 9 | 1 | 130 | 466.543 | 8 | ↓ |