In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 23 | Yes |
Popular Name: 4-chlorobenzyl 4-ethyl-5-(4-morpholinylmethyl)-4H-1,2,4-triazol-3-yl sulfide 4-chlorobenzyl 4-ethyl-5-(4-morp…
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) | 2.78 | 8.25 | -9.55 | 0 | 5 | 0 | 43 | 352.891 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.78 | 10.52 | -45.58 | 1 | 5 | 1 | 44 | 353.899 | 6 | ↓ |