General Information of the Compound
| Compound ID |
CP0903567
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| Compound Name |
(S)-Methyl 2-(3-Aminopropanoyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
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| Structure |
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| Formula |
C16H19N3O3
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| Molecular Weight |
301.346
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| Canonical SMILES |
COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)CN1C(=O)CCN
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| InChI |
InChI=1S/C16H19N3O3/c1-22-16(21)14-8-11-10-4-2-3-5-12(10)18-13(11)9-19(14)15(20)6-7-17/h2-5,14,18H,6-9,17H2,1H3/t14-/m0/s1
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| InChIKey |
DVHRYJBISMNEEB-AWEZNQCLSA-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