In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 15 | No |
Popular Name: 5-methyl-4-(1,1,3,3-tetramethylbutyl)-1,2,4-triazole-3-thiol 5-methyl-4-(1,1,3,3-tetramethylb…
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) | 2.32 | 6.69 | -11.64 | 1 | 3 | 0 | 34 | 227.377 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.04 | 6.92 | -48.73 | 0 | 3 | -1 | 31 | 226.369 | 3 | ↓ |