In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2005 | 22 | Yes |
Popular Name: 6-(4-methoxyphenyl)-2-piperazin-1-yl-pyrimidine-4-carbonitrile 6-(4-methoxyphenyl)-2-piperazin-…
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) | 2.21 | 7.95 | -48.04 | 2 | 6 | 1 | 79 | 296.354 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.21 | 6.67 | -7.36 | 1 | 6 | 0 | 74 | 295.346 | 3 | ↓ |