General Information of the Compound
| Compound ID |
CP0782210
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| Compound Name |
(+)-((1S,2S)-2-(5-chloro-2-(2-fluoroallyloxy)phenyl)cyclopropyl)methanamine hydrochloride
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| Structure |
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| Formula |
C13H16Cl2FNO
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| Molecular Weight |
292.181
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| Canonical SMILES |
C=C(F)COc1ccc(Cl)cc1[C@H]1C[C@@H]1CN.Cl
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| InChI |
InChI=1S/C13H15ClFNO.ClH/c1-8(15)7-17-13-3-2-10(14)5-12(13)11-4-9(11)6-16;/h2-3,5,9,11H,1,4,6-7,16H2;1H/t9-,11+;/m1./s1
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| InChIKey |
SQRGDUIVPQUHPV-XQKZEKTMSA-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: PT01019, 5-hydroxytryptamine receptor 2B
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2