In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2010 | 36 | No |
Popular Name: N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]-3-[(4-oxo-4-phenyl-butanoyl)amino]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) | 4.27 | 11.95 | -27.16 | 2 | 10 | 0 | 147 | 501.524 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.33 | 9.59 | -46.4 | 1 | 10 | -1 | 153 | 500.516 | 9 | ↓ |