In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2014 | 26 | Yes |
Popular Name: 4-amino-5-(4-tert-butylphenyl)-4H-[1,2,4]TRIAZOLE-3-thiol 4-amino-5-(4-tert-butylphenyl)-4…
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) | 1.66 | 11.85 | -59.55 | 0 | 6 | -1 | 87 | 425.299 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.