In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2010 | 23 | Yes |
Popular Name: N-(2-dimethylaminoethyl)-4-fluoro-N-(3-pyridylmethyl)benzenesulfonamide N-(2-dimethylaminoethyl)-4-fluor…
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) | 1.61 | 6.85 | -55.14 | 1 | 5 | 1 | 55 | 338.428 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.61 | 4.37 | -12.04 | 0 | 5 | 0 | 54 | 337.42 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.