In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 18th, 2011 | 17 | Yes |
Popular Name: 1-[(2R)-2-amino-2-cyclopropyl-ethyl]quinoxalin-2-one 1-[(2R)-2-amino-2-cyclopropyl-et…
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) | 0.98 | 4.29 | -44.96 | 3 | 4 | 1 | 63 | 230.291 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.98 | 3.96 | -8.32 | 2 | 4 | 0 | 61 | 229.283 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.