In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 19 | No |
Popular Name: 4-hydroxy-3-nitro-N-(1,3,4-thiadiazol-2-yl)benzenesulfonamide 4-hydroxy-3-nitro-N-(1,3,4-thiad…
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) | 1.09 | 0.74 | -45.18 | 1 | 9 | -1 | 140 | 301.285 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.09 | 1.72 | -91.14 | 0 | 9 | -2 | 143 | 300.277 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.09 | 0.68 | -19.88 | 2 | 9 | 0 | 138 | 302.293 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.