General Information of the Compound
| Compound ID |
CP0087270
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| Compound Name |
SB-649868
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| Synonyms |
1L1V1K2M4V
380899-24-1
4-Benzofurancarboxamide, N-(((2S)-1-((5-(4-fluorophenyl)-2-m
AKOS027323765
BDBM50417257
CHEMBL1272307
CS-7584
DTXSID90191491
EX-A2570
GTPL4461
HY-10806
N-((1-((5-(4-Fluorophenyl)-2-methyl-4-thiazolyl)carbonyl)-2-piperidinyl)methyl)-4-benzofurancarboxamide
N-[[(2S)-1-[5-(4-fluorophenyl)-2-methyl-1,3-thiazole-4-carbonyl]piperidin-2-yl]methyl]-1-benzofuran-4-carboxamide
SB 649868
SB-649,868
SB-649868
SB19110
SB649868
SCHEMBL8045969
UNII-1L1V1K2M4V
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| Structure |
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| Formula |
C26H24FN3O3S
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| Molecular Weight |
477.561
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| Canonical SMILES |
Cc1nc(C(=O)N2CCCC[C@H]2CNC(=O)c2cccc3occc23)c(s1)-c1ccc(F)cc1
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| InChI |
InChI=1S/C26H24FN3O3S/c1-16-29-23(24(34-16)17-8-10-18(27)11-9-17)26(32)30-13-3-2-5-19(30)15-28-25(31)21-6-4-7-22-20(21)12-14-33-22/h4,6-12,14,19H,2-3,5,13,15H2,1H3,(H,28,31)/t19-/m0/s1
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| InChIKey |
ZJXIUGNEAIHSBI-IBGZPJMESA-N
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| CAS |
380899-24-1
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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: PT03519, Orexin receptor type 2
Protein ID: PT01132, Orexin receptor type 2
Protein ID: PT03559, Orexin/Hypocretin receptor type 1
Protein ID: PT02001, Orexin/Hypocretin receptor type 1
Clinical Information about the Compound