In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 2008 | 22 | Yes |
Popular Name: N-[(1S)-2-[(5-butyl-1,3,4-thiadiazol-2-yl)amino]-1-methyl-2-oxo-ethyl]furan-2-carboxamide N-[(1S)-2-[(5-butyl-1,3,4-thiadi…
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) | 1.59 | 4.42 | -18.73 | 2 | 7 | 0 | 97 | 322.39 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.77 | 3.35 | -44.45 | 1 | 7 | -1 | 103 | 321.382 | 7 | ↓ |