In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 20 | Yes |
Popular Name: [(2S)-2-(aminomethyl)morpholin-4-yl]-quinoxalin-6-yl-methanone [(2S)-2-(aminomethyl)morpholin-4…
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) | -0.69 | 0.65 | -52.38 | 3 | 6 | 1 | 83 | 273.316 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.69 | 0.27 | -10.74 | 2 | 6 | 0 | 81 | 272.308 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.