In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2011 | 19 | Yes |
Popular Name: (1R)-1-(5-quinoxalin-6-yl-1,3,4-oxadiazol-2-yl)propan-1-amine (1R)-1-(5-quinoxalin-6-yl-1,3,4-…
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) | -0.50 | -1.53 | -50.22 | 3 | 6 | 1 | 92 | 256.289 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.50 | -1.89 | -11.19 | 2 | 6 | 0 | 91 | 255.281 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.