General Information of the Compound
| Compound ID |
CP0223822
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| Compound Name |
CHEBI:29009
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| Synonyms |
1-Methyl-1H-imidazole-4-ethanamine
1-Methyl-4-(2-aminoethyl)imidazole
1-Methyl-4-(beta-aminoethyl)imidazole
1-Methyl-4-histamine
1-Methylhistamine
1-methyl-4-(b-aminoethyl)imidazole
1H-Imidazole-4-ethanamine, 1-methyl-
2-(1-methyl-1H-imidazol-4-yl)ethan-1-amine
2-(1-methyl-1H-imidazol-4-yl)ethanamine
501-75-7
BRN 0110757
CHEBI:29009
KCB81T4EOF
N(sup 1)-Methylhistamine
N-Telle-methylhistamine
N-[3H]methylhistamine
N-tele-Methylhistamine
N1-Methylhistamine
NSC 66736
Tele-methylhistamine
UNII-KCB81T4EOF
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| Structure |
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| Formula |
C6H11N3
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| Molecular Weight |
125.175
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| Canonical SMILES |
Cn1cnc(CCN)c1
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| InChI |
InChI=1S/C6H11N3/c1-9-4-6(2-3-7)8-5-9/h4-5H,2-3,7H2,1H3
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| InChIKey |
FHQDWPCFSJMNCT-UHFFFAOYSA-N
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| CAS |
501-75-7
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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
Clinical Information about the Compound