In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2004 | 31 | Yes |
Popular Name: 4-[4-(tert-butyl)phenyl]-3-[(4-chlorobenzyl)thio]-5-(2-chlorophenyl)-4H-1,2,4-triazole 4-[4-(tert-butyl)phenyl]-3-[(4-c…
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) | 8.32 | 17.9 | -10.31 | 0 | 3 | 0 | 31 | 468.453 | 6 | ↓ |