In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2004 | 19 | No |
Popular Name: 4-[(E)-(2,4-dichlorobenzylidene)amino]-5-(difluoromethyl)-1,2,4-triazole-3-thiolate 4-[(E)-(2,4-dichlorobenzylidene)…
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) | 3.54 | 9.23 | -47.02 | 0 | 4 | -1 | 43 | 322.147 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.81 | 8.36 | -7.8 | 1 | 4 | 0 | 46 | 323.155 | 3 | ↓ |