dextrorphan   Click here for help

GtoPdb Ligand ID: 9052

Compound class: Synthetic organic
Comment: Dextrorphan is an NMDA receptor antagonist. It is the dextro-rotatory isomer of levorphanol and is also an active metabolite of dextromethorphan.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 0
Topological polar surface area 23.47
Molecular weight 257.18
XLogP 3.29
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES Oc1ccc2c(c1)C13CCCCC3C(C2)N(CC1)C
Isomeric SMILES Oc1ccc2c(c1)[C@@]13CCCC[C@@H]3[C@H](C2)N(CC1)C
InChI InChI=1S/C17H23NO/c1-18-9-8-17-7-3-2-4-14(17)16(18)10-12-5-6-13(19)11-15(12)17/h5-6,11,14,16,19H,2-4,7-10H2,1H3/t14-,16+,17+/m1/s1
InChI Key JAQUASYNZVUNQP-PVAVHDDUSA-N
Classification Click here for help
Compound class Synthetic organic
Database Links Click here for help
BindingDB Ligand 50001000
ChEMBL Ligand CHEMBL1254766
GtoPdb PubChem SID 315661137
PubChem CID 5360697
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