In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 17 | Yes |
Popular Name: 1-[(2R)-2-hydroxy-3-methylamino-propyl]quinoxalin-2-one 1-[(2R)-2-hydroxy-3-methylamino-…
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) | 0.39 | 1.79 | -45.07 | 3 | 5 | 1 | 72 | 234.279 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.39 | 0.22 | -10.57 | 2 | 5 | 0 | 67 | 233.271 | 4 | ↓ |