In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 10th, 2011 | 27 | Yes |
Popular Name: 4-[4-(3,5-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazine-1-carbonyl]benzonitrile 4-[4-(3,5-dimethyl-[1,2,4]triazo…
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) | 0.80 | 12.27 | -24.93 | 0 | 8 | 0 | 90 | 361.409 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.