General Information of the Compound
| Compound ID |
CP0195739
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| Compound Name |
(S)-tetrahydrofuran-3-yl 4-(hydroxycarbamoyl)-4-((4-o-tolylpiperazin-1-ylsulfonyl)methyl)piperidine-1-carboxylate
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| Structure |
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| Formula |
C23H34N4O7S
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| Molecular Weight |
510.613
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| Canonical SMILES |
Cc1ccccc1N1CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)O[C@H]1CCOC1)C(=O)NO
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| InChI |
InChI=1S/C23H34N4O7S/c1-18-4-2-3-5-20(18)25-11-13-27(14-12-25)35(31,32)17-23(21(28)24-30)7-9-26(10-8-23)22(29)34-19-6-15-33-16-19/h2-5,19,30H,6-17H2,1H3,(H,24,28)/t19-/m0/s1
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| InChIKey |
MQRVNMRQQSVHCA-IBGZPJMESA-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