In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2004 | 27 | No |
Popular Name: 3-[(2-chloro-6-nitro-benzyl)thio]-4-methyl-5-[(2-methylphenoxy)methyl]-1,2,4-triazole 3-[(2-chloro-6-nitro-benzyl)thio…
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) | 4.67 | 2.1 | -17.37 | 0 | 7 | 0 | 85 | 404.879 | 7 | ↓ |