General Information of the Compound
| Compound ID |
CP0574259
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| Compound Name |
(1S)-1-(6-tert-butyl-1H-benzimidazol-2-yl)butan-1-amine
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| Structure |
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| Formula |
C15H23N3
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| Molecular Weight |
245.37
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| Canonical SMILES |
CCC[C@H](N)c1nc2cc(ccc2[nH]1)C(C)(C)C
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| InChI |
InChI=1S/C15H23N3/c1-5-6-11(16)14-17-12-8-7-10(15(2,3)4)9-13(12)18-14/h7-9,11H,5-6,16H2,1-4H3,(H,17,18)/t11-/m0/s1
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| InChIKey |
DNMKVXZFABXGQL-NSHDSACASA-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