General Information of the Compound
| Compound ID |
CP0454931
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| Compound Name |
(2S)-N-cyclopentyl-2-(2-hydroxyacetamido)-7-sulfanylheptanamide
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| Structure |
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| Formula |
C14H26N2O3S
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| Molecular Weight |
302.44
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| Canonical SMILES |
OCC(=O)N[C@@H](CCCCCS)C(=O)NC1CCCC1
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| InChI |
InChI=1S/C14H26N2O3S/c17-10-13(18)16-12(8-2-1-5-9-20)14(19)15-11-6-3-4-7-11/h11-12,17,20H,1-10H2,(H,15,19)(H,16,18)/t12-/m0/s1
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| InChIKey |
YFJMWUCZDQRYEZ-LBPRGKRZSA-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
Protein ID: PT00991, Histone deacetylase 1
Protein ID: PT00994, Histone deacetylase 4
Protein ID: PT03064, Histone deacetylase 6