In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 34 | No |
Popular Name: N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]-4-(p-tolylsulfonylamino)benzamide N-[5-(4-nitrophenyl)-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) | 4.64 | 9.13 | -24.2 | 2 | 10 | 0 | 147 | 495.542 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.71 | 6.94 | -102.88 | 0 | 10 | -2 | 155 | 493.526 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.71 | 6.8 | -47.11 | 1 | 10 | -1 | 153 | 494.534 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.64 | 9.27 | -54.82 | 1 | 10 | -1 | 149 | 494.534 | 7 | ↓ |