| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 23 | Yes |
Popular Name: 4-(4-benzylpiperazin-1-yl)-6-methylsulfanyl-pyrimidine-5-carbonitrile 4-(4-benzylpiperazin-1-yl)-6-met…
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| 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) | 2.15 | 11 | -41.05 | 1 | 5 | 1 | 57 | 326.449 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.15 | 8.77 | -6.67 | 0 | 5 | 0 | 56 | 325.441 | 4 | ↓ |
