In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 5th, 2011 | 21 | Yes |
Popular Name: (3aR)-N-(1,3-benzodioxol-5-yl)-3a,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxamide (3aR)-N-(1,3-benzodioxol-5-yl)-3…
None
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) | 1.49 | 5.09 | -46.58 | 3 | 7 | 1 | 81 | 287.299 | 1 | ↓ |
Ref Reference (pH 7) | 1.49 | 5.08 | -46.43 | 3 | 7 | 1 | 81 | 287.299 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.49 | 4.62 | -15.01 | 2 | 7 | 0 | 79 | 286.291 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.49 | 4.62 | -12.22 | 2 | 7 | 0 | 79 | 286.291 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.