In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2009 | 20 | Yes |
Popular Name: 4-[(1R)-1-hydroxyethyl]-N-(3-methyl-2-pyridyl)benzenesulfonamide 4-[(1R)-1-hydroxyethyl]-N-(3-met…
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) | 1.95 | 3.13 | -17.85 | 2 | 5 | 0 | 83 | 292.36 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.77 | 2.66 | -51.61 | 1 | 5 | -1 | 81 | 291.352 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.