In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2011 | 19 | Yes |
Popular Name: (1S)-N-methyl-1-(5-quinoxalin-6-yl-1,3,4-oxadiazol-2-yl)ethanamine (1S)-N-methyl-1-(5-quinoxalin-6-…
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) | 1.25 | -0.67 | -46.15 | 2 | 6 | 1 | 81 | 256.289 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.25 | -1.99 | -10.89 | 1 | 6 | 0 | 77 | 255.281 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.