IMPPAT: Indian Medicinal Plants, Phytochemistry And Therapeutics
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IMPPAT Phytochemical information:
Dimethylamine hydrochloride
Summary
Physicochemical
Drug-likeness
ADMET
Descriptors
Summary
IMPPAT Phytochemical identifier:
IMPHY000594
Phytochemical name:
Dimethylamine hydrochloride
Synonymous chemical names:
bimethylamine
External chemical identifiers:
CID:10473
,
ChEMBL:CHEMBL569461
,
FDASRS:7M4CWB6AOK
,
SureChEMBL:SCHEMBL733
,
MolPort-003-926-165
Chemical structure information
SMILES:
CNC.Cl
InChI:
InChI=1S/C2H7N.ClH/c1-3-2;/h3H,1-2H3;1H
InChIKey:
IQDGSYLLQPDQDV-UHFFFAOYSA-N
DeepSMILES:
CNC.Cl
Functional groups:
CNC, Cl
Chemical classification
ClassyFire Kingdom:
Organic compounds
ClassyFire Superclass:
Organic nitrogen compounds
ClassyFire Class:
Organonitrogen compounds
ClassyFire Subclass:
Amines
NP Classifier Biosynthetic pathway:
Amino acids and Peptides, Shikimates and Phenylpropanoids
NP Classifier Superclass:
Small peptides
NP Classifier Class:
Aminoacids
NP-Likeness score:
-0.127
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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