In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 27 | Yes |
Popular Name: 2-tert-butyl-7-(4-but-2-ynylpiperazin-1-yl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine 2-tert-butyl-7-(4-but-2-ynylpipe…
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) | 4.96 | 10.35 | -7.59 | 0 | 5 | 0 | 37 | 379.43 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.96 | 12.6 | -47.33 | 1 | 5 | 1 | 38 | 380.438 | 4 | ↓ |