In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2011 | 20 | Yes |
Popular Name: (1S)-N-ethyl-1-[5-(8-quinolyl)-1,3,4-oxadiazol-2-yl]ethanamine (1S)-N-ethyl-1-[5-(8-quinolyl)-1…
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) | 1.81 | 2.67 | -43.42 | 2 | 5 | 1 | 68 | 269.328 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.81 | 1.49 | -15.17 | 1 | 5 | 0 | 64 | 268.32 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.