5MP

5-METHYLPYRROLE

Created:	2002-04-18
Last modified:	2011-06-04

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1 entries where 5MP is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	13
Chiral Atom Count	0
Bond Count	13
Aromatic Bond Count	5

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Chemical Component Summary
Name	5-METHYLPYRROLE
Systematic Name (OpenEye OEToolkits)	3-methyl-1H-pyrrole
Formula	C₅ H₇ N
Molecular Weight	81.116
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	c1cc(cn1)C
SMILES	CACTVS	3.341	Cc1c[nH]cc1
SMILES	OpenEye OEToolkits	1.5.0	Cc1cc[nH]c1
Canonical SMILES	CACTVS	3.341	Cc1c[nH]cc1
Canonical SMILES	OpenEye OEToolkits	1.5.0	Cc1cc[nH]c1
InChI	InChI	1.03	InChI=1S/C5H7N/c1-5-2-3-6-4-5/h2-4,6H,1H3
InChIKey	InChI	1.03	FEKWWZCCJDUWLY-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB01932
Name	5-Methylpyrrole
Groups	experimental
Synonyms	5-Methylpyrrole
CAS number	616-43-3

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Lysozyme	MNIFEMLRIDERLRLKIYKDTEGYYTIGIGHLLTKSPSLNAAKSELDKAI...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682