General Information of the Compound
| Compound ID |
CP0863941
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| Compound Name |
rac-(7-(3,4-Dichlorophenyl)-2,5-dimethyl-4,7-dihydropyrazolo-[1,5-a]pyrimidin-6-yl)(4-phenylpiperazin-1-yl)methanone
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| Structure |
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| Formula |
C25H25Cl2N5O
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| Molecular Weight |
482.415
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| Canonical SMILES |
CC1=C(C(=O)N2CCN(c3ccccc3)CC2)C(c2ccc(Cl)c(Cl)c2)n2nc(C)cc2N1
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| InChI |
InChI=1S/C25H25Cl2N5O/c1-16-14-22-28-17(2)23(24(32(22)29-16)18-8-9-20(26)21(27)15-18)25(33)31-12-10-30(11-13-31)19-6-4-3-5-7-19/h3-9,14-15,24,28H,10-13H2,1-2H3
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| InChIKey |
PXLAWAKMGPZFON-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound