General Information of the Compound
| Compound ID |
CP0552574
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| Compound Name |
1-cyclopentyl-5-(2,6-dimethoxyphenyl)-N-[(3S)-1-(2-methoxyethylamino)-1-oxo-5-piperidin-1-ylpentan-3-yl]pyrazole-3-carboxamide
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| Structure |
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| Formula |
C30H45N5O5
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| Molecular Weight |
555.72
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| Canonical SMILES |
COCCNC(=O)C[C@H](CCN1CCCCC1)NC(=O)c1cc(-c2c(OC)cccc2OC)n(n1)C1CCCC1
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| InChI |
InChI=1S/C30H45N5O5/c1-38-19-15-31-28(36)20-22(14-18-34-16-7-4-8-17-34)32-30(37)24-21-25(35(33-24)23-10-5-6-11-23)29-26(39-2)12-9-13-27(29)40-3/h9,12-13,21-23H,4-8,10-11,14-20H2,1-3H3,(H,31,36)(H,32,37)/t22-/m0/s1
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| InChIKey |
IZYNODDOQNUMHU-QFIPXVFZSA-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