In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2010 | 19 | Yes |
Popular Name: N-[[5-[(1S)-tetralin-1-yl]-1,2,4-oxadiazol-3-yl]methyl]ethanamine N-[[5-[(1S)-tetralin-1-yl]-1,2,4…
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) | 2.32 | 5.84 | -39.52 | 2 | 4 | 1 | 56 | 258.345 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.32 | 4.47 | -6.65 | 1 | 4 | 0 | 51 | 257.337 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.