In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 21 | Yes |
Popular Name: 4-[[5-(2-cyclohexylethyl)-1,3,4-thiadiazol-2-yl]amino]-4-oxo-butanoic 4-[[5-(2-cyclohexylethyl)-1,3,4-…
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) | 2.27 | 6.96 | -55.34 | 1 | 6 | -1 | 95 | 310.399 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.27 | 5.84 | -18.86 | 2 | 6 | 0 | 92 | 311.407 | 7 | ↓ |