In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 17 | Yes |
Popular Name: 5-fluoro-2-[(2R,4R)-4-methoxypyrrolidin-2-yl]-1,3-benzothiazole 5-fluoro-2-[(2R,4R)-4-methoxypyr…
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) | 2.09 | 4.09 | -40.64 | 2 | 3 | 1 | 39 | 253.322 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.09 | 2.72 | -7.26 | 1 | 3 | 0 | 34 | 252.314 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.