LDV

3-[(4-methylpiperidin-1-yl)methyl]-1H-indole

Created:	2019-02-22
Last modified:	2019-05-08

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3 entries where LDV is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	37
Chiral Atom Count	0
Bond Count	39
Aromatic Bond Count	10

2D diagram of LDV

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Chemical Component Summary
Name	3-[(4-methylpiperidin-1-yl)methyl]-1H-indole
Systematic Name (OpenEye OEToolkits)	3-[(4-methylpiperidin-1-yl)methyl]-1~{H}-indole
Formula	C₁₅ H₂₀ N₂
Molecular Weight	228.333
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	N1(CCC(CC1)C)Cc3c2c(cccc2)nc3
SMILES	CACTVS	3.385	CC1CCN(CC1)Cc2c[nH]c3ccccc23
SMILES	OpenEye OEToolkits	2.0.6	CC1CCN(CC1)Cc2c[nH]c3c2cccc3
Canonical SMILES	CACTVS	3.385	CC1CCN(CC1)Cc2c[nH]c3ccccc23
Canonical SMILES	OpenEye OEToolkits	2.0.6	CC1CCN(CC1)Cc2c[nH]c3c2cccc3
InChI	InChI	1.03	InChI=1S/C15H20N2/c1-12-6-8-17(9-7-12)11-13-10-16-15-5-3-2-4-14(13)15/h2-5,10,12,16H,6-9,11H2,1H3
InChIKey	InChI	1.03	DGCGMYNLCDVYMB-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	30438
ChEMBL	CHEMBL57478

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