In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 20 | Yes |
Popular Name: (5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-(4-methylpiperazin-1-yl)methanone (5,7-dimethyl-[1,2,4]triazolo[1,…
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) | -0.06 | 6.03 | -15.97 | 0 | 7 | 0 | 67 | 274.328 | 1 | ↓ |
Mid Mid (pH 6-8) | -0.06 | 8.43 | -47.12 | 1 | 7 | 1 | 68 | 275.336 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.