In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 19 | Yes |
Popular Name: N-[[2-[(1S,4R)-5-azabicyclo[2.2.1]heptan-5-yl]-4-propyl-thiazol-5-yl]methyl]ethanamine N-[[2-[(1S,4R)-5-azabicyclo[2.2.…
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) | 3.46 | 8.95 | -38.87 | 2 | 3 | 1 | 33 | 280.461 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.46 | 7.57 | -6.05 | 1 | 3 | 0 | 28 | 279.453 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.