In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 15th, 2011 | 22 | Yes |
Popular Name: 3-[(1S,5R)-8-tert-butyl-8-azabicyclo[3.2.1]oct-3-en-3-yl]-1,2-benzothiazol-5-ol 3-[(1S,5R)-8-tert-butyl-8-azabic…
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) | 4.06 | 6.97 | -36.38 | 2 | 3 | 1 | 38 | 315.462 | 2 | ↓ |
Hi High (pH 8-9.5) | 4.06 | 4.93 | -7.4 | 1 | 3 | 0 | 36 | 314.454 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.