General Information of the Compound
Compound ID |
CP0816856
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Compound Name |
(S)-valylglycyl-(S)-alanyl-(S)-prolylglycine
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Structure |
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Formula |
C17H29N5O6
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Molecular Weight |
399.448
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Canonical SMILES |
CC(C)[C@H](N)C(=O)NCC(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)NCC(=O)O
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InChI |
InChI=1S/C17H29N5O6/c1-9(2)14(18)16(27)19-7-12(23)21-10(3)17(28)22-6-4-5-11(22)15(26)20-8-13(24)25/h9-11,14H,4-8,18H2,1-3H3,(H,19,27)(H,20,26)(H,21,23)(H,24,25)/t10-,11-,14-/m0/s1
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InChIKey |
KGRJWMZFVYOGDR-MJVIPROJSA-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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