General Information of the Compound
| Compound ID |
CP0459903
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| Compound Name |
N-[(3R)-1-cyclopentylpyrrolidin-3-yl]-N-methyl-4-pyrazol-1-ylbenzamide
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| Structure |
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| Formula |
C20H26N4O
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| Molecular Weight |
338.455
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| Canonical SMILES |
CN([C@@H]1CCN(C1)C1CCCC1)C(=O)c1ccc(cc1)-n1cccn1
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| InChI |
InChI=1S/C20H26N4O/c1-22(19-11-14-23(15-19)17-5-2-3-6-17)20(25)16-7-9-18(10-8-16)24-13-4-12-21-24/h4,7-10,12-13,17,19H,2-3,5-6,11,14-15H2,1H3/t19-/m1/s1
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| InChIKey |
MKCPKLRBORNGKZ-LJQANCHMSA-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