In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2009 | 32 | Yes |
Popular Name: 4-(difluoromethyl)-6-(3,4-dimethoxyphenyl)-2-[4-(3-pyridylmethyl)piperazin-1-yl]pyrimidine 4-(difluoromethyl)-6-(3,4-dimeth…
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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) | 3.34 | 12.42 | -51.04 | 1 | 7 | 1 | 65 | 442.49 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.34 | 10.22 | -13.22 | 0 | 7 | 0 | 64 | 441.482 | 7 | ↓ |