General Information of the Compound
| Compound ID |
CP0395627
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| Compound Name |
1-[1-(3,4-dichlorophenyl)pyrazol-3-yl]oxy-3-(4-methylpiperazin-1-yl)propan-2-ol
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| Structure |
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| Formula |
C17H22Cl2N4O2
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| Molecular Weight |
385.295
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| Canonical SMILES |
CN1CCN(CC(O)COc2ccn(n2)-c2ccc(Cl)c(Cl)c2)CC1
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| InChI |
InChI=1S/C17H22Cl2N4O2/c1-21-6-8-22(9-7-21)11-14(24)12-25-17-4-5-23(20-17)13-2-3-15(18)16(19)10-13/h2-5,10,14,24H,6-9,11-12H2,1H3
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| InChIKey |
MEPYQUAPJWBMJH-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