General Information of the Compound
| Compound ID |
CP0245643
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| Compound Name |
(R,S)-1-(5-chloro-1H-indol-1-yl)propan-2-amine
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| Synonyms |
(R,S)-1-(5-chloro-1H-indol-1-yl)propan-2-amine
169674-96-8
1H-Indole-1-ethanamine, 5-chloro-alpha-methyl-
BDBM50321880
CHEMBL328844
SCHEMBL7092716
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| Structure |
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| Formula |
C11H13ClN2
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| Molecular Weight |
208.692
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| Canonical SMILES |
CC(N)Cn1ccc2cc(Cl)ccc12
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| InChI |
InChI=1S/C11H13ClN2/c1-8(13)7-14-5-4-9-6-10(12)2-3-11(9)14/h2-6,8H,7,13H2,1H3
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| InChIKey |
XXCLNSYNUQMDML-UHFFFAOYSA-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
Clinical Information about the Compound