General Information of the Compound
| Compound ID |
CP0402452
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| Compound Name |
N-[(E)-3-(2-amino-1H-imidazol-5-yl)prop-2-enyl]-5-chloro-1H-indole-2-carboxamide
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| Structure |
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| Formula |
C15H14ClN5O
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| Molecular Weight |
315.764
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| Canonical SMILES |
Nc1nc(\C=C\CNC(=O)c2cc3cc(Cl)ccc3[nH]2)c[nH]1
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| InChI |
InChI=1S/C15H14ClN5O/c16-10-3-4-12-9(6-10)7-13(21-12)14(22)18-5-1-2-11-8-19-15(17)20-11/h1-4,6-8,21H,5H2,(H,18,22)(H3,17,19,20)/b2-1+
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| InChIKey |
KZGCMSHMRDZXCJ-OWOJBTEDSA-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: PT02933, Potassium voltage-gated channel subfamily A member 1
Protein ID: PT03487, Potassium voltage-gated channel subfamily A member 2
Protein ID: PT02298, Potassium voltage-gated channel subfamily A member 3
Protein ID: PT05924, Potassium voltage-gated channel subfamily A member 4
Protein ID: PT02768, Potassium voltage-gated channel subfamily A member 5
Protein ID: PT04271, Potassium voltage-gated channel subfamily A member 6