In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2009 | 31 | Yes |
Popular Name: N-cyclohexyl-N-[3-oxo-3-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]propyl]heptanamide N-cyclohexyl-N-[3-oxo-3-[(5-phen…
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) | 6.23 | 12.94 | -22.35 | 1 | 6 | 0 | 75 | 442.629 | 11 | ↓ |
Hi High (pH 8-9.5) | 6.42 | 11.85 | -54.53 | 0 | 6 | -1 | 82 | 441.621 | 11 | ↓ |