[3H]5-CT   Click here for help

GtoPdb Ligand ID: 262

Synonyms: [3H]5-carboxamidotryptamine [4] | tritiated 5-carbamidotryptamine
 Ligand is labelled  Ligand is radioactive
Compound class: Synthetic organic
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 3
Hydrogen bond donors 3
Rotatable bonds 3
Topological polar surface area 84.9
Molecular weight 203.11
XLogP 0.3
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES NCCc1c[nH]c2c1cc(cc2)C(=O)N
Isomeric SMILES NC(=O)c1ccc2c(c1)c(c[nH]2)C(C(N)([3H])[3H])([3H])[3H]
InChI InChI=1S/C11H13N3O/c12-4-3-8-6-14-10-2-1-7(11(13)15)5-9(8)10/h1-2,5-6,14H,3-4,12H2,(H2,13,15)/i3T2,4T2
InChI Key WKZLNEWVIAGNAW-DOMYTETQSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
3-(2-amino-1,1,2,2-tetratritioethyl)-1H-indole-5-carboxamide
Synonyms Click here for help
[3H]5-carboxamidotryptamine [4] | tritiated 5-carbamidotryptamine
Database Links Click here for help
ChEMBL Ligand CHEMBL1628596
GtoPdb PubChem SID 135651128
PubChem CID 53324620
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