IMPPAT: Indian Medicinal Plants, Phytochemistry And Therapeutics
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IMPPAT Phytochemical information:
Tetradecylamine
Summary
Physicochemical
Drug-likeness
ADMET
Descriptors
Summary
IMPPAT Phytochemical identifier:
IMPHY013788
Phytochemical name:
Tetradecylamine
Synonymous chemical names:
1-tetradecanamine
External chemical identifiers:
CID:16217
,
ChEMBL:CHEMBL110011
,
ChEBI:165595
,
ZINC:ZINC000001545440
,
FDASRS:NOM20L9LFT
,
SureChEMBL:SCHEMBL27093
,
MolPort-003-939-509
Chemical structure information
SMILES:
CCCCCCCCCCCCCCN
InChI:
InChI=1S/C14H31N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h2-15H2,1H3
InChIKey:
PLZVEHJLHYMBBY-UHFFFAOYSA-N
DeepSMILES:
CCCCCCCCCCCCCCN
Functional groups:
CN
Chemical classification
ClassyFire Kingdom:
Organic compounds
ClassyFire Superclass:
Organic nitrogen compounds
ClassyFire Class:
Organonitrogen compounds
ClassyFire Subclass:
Amines
NP Classifier Biosynthetic pathway:
Fatty acids
NP Classifier Superclass:
Fatty acyls
NP Classifier Class:
Hydrocarbons
NP-Likeness score:
0.385
Chemical structure download
2D:
2D MOL
2D MOL2
2D SDF
3D:
3D MOL
3D MOL2
3D SDF
3D PDB
3D PDBQT
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