General Information of the Compound
| Compound ID |
CP0098801
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| Compound Name |
(6S,7S)-6-(4-m-tolyl-piperazine-1-carbonyl)-5-aza-spiro[2.5]octane-7-carboxylic acid hydroxyamide
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| Structure |
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| Formula |
C20H28N4O3
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| Molecular Weight |
372.469
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| Canonical SMILES |
Cc1cccc(c1)N1CCN(CC1)C(=O)[C@H]1NCC2(CC2)C[C@@H]1C(=O)NO
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| InChI |
InChI=1S/C20H28N4O3/c1-14-3-2-4-15(11-14)23-7-9-24(10-8-23)19(26)17-16(18(25)22-27)12-20(5-6-20)13-21-17/h2-4,11,16-17,21,27H,5-10,12-13H2,1H3,(H,22,25)/t16-,17-/m0/s1
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| InChIKey |
KAJHXHOIEARPHN-IRXDYDNUSA-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