In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 2nd, 2006 | 18 | No |
Popular Name: 5-[(2-isopropylphenoxy)methyl]-4-methyl-1,2,4-triazole-3-thiol 5-[(2-isopropylphenoxy)methyl]-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) | 2.92 | 8.6 | -45.87 | 0 | 4 | -1 | 40 | 262.358 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.19 | 8.64 | -14.19 | 1 | 4 | 0 | 43 | 263.366 | 4 | ↓ |