In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 21 | Yes |
Popular Name: [(1R,2R,4R)-4-propyl-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)cyclohexyl]methanamine [(1R,2R,4R)-4-propyl-2-([1,2,4]t…
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) | 3.51 | 9.16 | -59.78 | 3 | 4 | 1 | 58 | 305.471 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.