In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2009 | 20 | No |
Popular Name: 4-hydroxy-3-nitro-N-(4H-1,2,4-triazol-3-ylmethyl)benzenesulfonamide 4-hydroxy-3-nitro-N-(4H-1,2,4-tr…
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) | -0.37 | 1.33 | -48.56 | 2 | 10 | -1 | 157 | 298.26 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.37 | 0.34 | -18.37 | 3 | 10 | 0 | 154 | 299.268 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.