In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2010 | 20 | Yes |
Popular Name: (1R)-1-[5-[(1S)-tetralin-1-yl]-1,2,4-oxadiazol-3-yl]butan-1-amine (1R)-1-[5-[(1S)-tetralin-1-yl]-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) | 1.31 | 5.22 | -42.82 | 3 | 4 | 1 | 67 | 272.372 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.31 | 4.93 | -5.57 | 2 | 4 | 0 | 65 | 271.364 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.