In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 29 | Yes |
Popular Name: N-[(1S,2S)-1-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]carbamoyl]-2-methyl-butyl]heptanamide N-[(1S,2S)-1-[[5-(4-bromophenyl)…
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 | 10.95 | -12.89 | 2 | 6 | 0 | 84 | 481.46 | 11 | ↓ |
Hi High (pH 8-9.5) | 6.42 | 9.37 | -40.62 | 1 | 6 | -1 | 90 | 480.452 | 11 | ↓ |