General Information of the Compound
| Compound ID |
CP0460908
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| Compound Name |
3-{2-[(R)-2-(3-Chloro-phenyl)-2-hydroxy-ethylamino]-propyl}-1H-indol-7-ol
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| Structure |
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| Formula |
C19H21ClN2O2
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| Molecular Weight |
344.842
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| Canonical SMILES |
CC(Cc1c[nH]c2c(O)cccc12)NC[C@H](O)c1cccc(Cl)c1
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| InChI |
InChI=1S/C19H21ClN2O2/c1-12(21-11-18(24)13-4-2-5-15(20)9-13)8-14-10-22-19-16(14)6-3-7-17(19)23/h2-7,9-10,12,18,21-24H,8,11H2,1H3/t12?,18-/m0/s1
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| InChIKey |
SAKZWBFZCQWUSG-ZJFPTPTDSA-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