In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2010 | 20 | No |
Popular Name: N-[(1R)-4-fluoroindan-1-yl]-2-thioxo-1H-pyridine-3-carboxamide N-[(1R)-4-fluoroindan-1-yl]-2-th…
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) | 2.54 | 6.6 | -59.77 | 1 | 3 | -1 | 42 | 287.339 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.81 | 6.95 | -34.45 | 2 | 3 | 0 | 45 | 288.347 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.