In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2010 | 25 | No |
Popular Name: 4,5-dicyclopropyl-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione 4,5-dicyclopropyl-2-[(4-pyrimidi…
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) | 0.65 | 11.76 | -13.93 | 0 | 7 | 0 | 55 | 357.487 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.