In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 15th, 2006 | 16 | No |
Popular Name: 5-(2-isopropoxyphenyl)-1,2-dihydro-1,2,4-triazole-3-thione 5-(2-isopropoxyphenyl)-1,2-dihyd…
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) | 2.97 | 6.53 | -49.67 | 1 | 4 | -1 | 51 | 234.304 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.97 | 6.8 | -22.79 | 2 | 4 | 0 | 52 | 235.312 | 3 | ↓ |