In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 22 | No |
Popular Name: 4-[(E)-(3,4-diethoxyphenyl)methyleneamino]-5-ethyl-1,2,4-triazole-3-thiol 4-[(E)-(3,4-diethoxyphenyl)methy…
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) | 1.94 | 9 | -19.27 | 1 | 6 | 0 | 64 | 320.418 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.67 | 9.45 | -49.74 | 0 | 6 | -1 | 62 | 319.41 | 7 | ↓ |