General Information of the Compound
| Compound ID |
CP0578055
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| Compound Name |
5-(2-methyl-2,7-diazaspiro[3.5]nonan-7-yl)-2-phenylmethoxy-N-pyridazin-4-ylbenzamide
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| Structure |
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| Formula |
C26H29N5O2
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| Molecular Weight |
443.551
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| Canonical SMILES |
CN1CC2(C1)CCN(CC2)c1ccc(OCc2ccccc2)c(c1)C(=O)Nc1ccnnc1
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| InChI |
InChI=1S/C26H29N5O2/c1-30-18-26(19-30)10-13-31(14-11-26)22-7-8-24(33-17-20-5-3-2-4-6-20)23(15-22)25(32)29-21-9-12-27-28-16-21/h2-9,12,15-16H,10-11,13-14,17-19H2,1H3,(H,27,29,32)
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| InChIKey |
HSDXXGYIJILLPK-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