General Information of the Compound
| Compound ID |
CP0050360
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| Compound Name |
(S)-2-amino-4-hydroxy-N-(4-octylphenyl)butanamide
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| Synonyms |
(S)-2-amino-4-hydroxy-N-(4-octylphenyl)butanamide
CHEMBL583979
QJTVTVAQRCRXSM-KRWDZBQOSA-N
SCHEMBL1311702
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| Structure |
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| Formula |
C18H30N2O2
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| Molecular Weight |
306.45
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| Canonical SMILES |
CCCCCCCCc1ccc(NC(=O)[C@@H](N)CCO)cc1
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| InChI |
InChI=1S/C18H30N2O2/c1-2-3-4-5-6-7-8-15-9-11-16(12-10-15)20-18(22)17(19)13-14-21/h9-12,17,21H,2-8,13-14,19H2,1H3,(H,20,22)/t17-/m0/s1
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| InChIKey |
QJTVTVAQRCRXSM-KRWDZBQOSA-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