In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2011 | 21 | Yes |
Popular Name: N-[(1S)-1-(5-quinoxalin-6-yl-1,3,4-oxadiazol-2-yl)ethyl]propan-1-amine N-[(1S)-1-(5-quinoxalin-6-yl-1,3…
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) | 2.13 | 0.94 | -45.53 | 2 | 6 | 1 | 81 | 284.343 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.13 | -0.24 | -11.3 | 1 | 6 | 0 | 77 | 283.335 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.