General Information of the Compound
| Compound ID |
CP0057171
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| Compound Name |
3-[(2-iodo-5-nitrophenyl)carbonyl]-1-[(1-methylpiperidin-2-yl)methyl]-1H-indole
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| Synonyms |
(1-(Methylpiperidin-2-ylmethyl)-3-(2-iodo-5-nitrobenzoyl)indole)
(2-iodo-5-nitrophenyl)(1-((1-methylpiperidin-2-yl)methyl)-1H-indol-3-yl)methanone
(R,S)-AM1241
444912-48-5
AKOS016004972
AM 1241
AM-1241
AM1241
ANW-62168
AX8233934
BDBM21283
CCG-208738
CHEMBL408430
CS-0011638
CTK8B9184
GTPL3316
HMS3650F09
HMS3651A13
HY-18640
KB-206133
LS-192021
MFCD11045986
MolPort-009-019-655
NCGC00165726-01
NCGC00165726-04
SB19545
SCHEMBL2030690
ST24033932
SW219858-1
TC-150913
Z-3231
ZUHIXXCLLBMBDW-UHFFFAOYSA-N
s1544
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| Structure |
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| Formula |
C22H22IN3O3
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| Molecular Weight |
503.34
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| Canonical SMILES |
CN1CCCCC1Cn1cc(C(=O)c2cc(ccc2I)[N+]([O-])=O)c2ccccc12
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| InChI |
InChI=1S/C22H22IN3O3/c1-24-11-5-4-6-16(24)13-25-14-19(17-7-2-3-8-21(17)25)22(27)18-12-15(26(28)29)9-10-20(18)23/h2-3,7-10,12,14,16H,4-6,11,13H2,1H3
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| InChIKey |
ZUHIXXCLLBMBDW-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
Protein ID: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2
Clinical Information about the Compound