Chemical Components in the PDB

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LZL : Summary

Code

LZL

One-letter code

X

Molecule name

7-(2,5-dihydropyrrol-1-yl)-6-phenyl-pyrido[6,5-d]pyrimidin-2-amine

Systematic names

ProgramVersionName
ACDLabs 10.04 7-(2,5-dihydro-1H-pyrrol-1-yl)-6-phenylpyrido[2,3-d]pyrimidin-2-amine
OpenEye OEToolkits 1.5.0 7-(2,5-dihydropyrrol-1-yl)-6-phenyl-pyrido[6,5-d]pyrimidin-2-amine

Formula

C17 H15 N5

Formal charge

0

Molecular weight

289.335 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 10.04 n3c2nc(c(c1ccccc1)cc2cnc3N)N4CC=CC4
SMILES CACTVS 3.341 Nc1ncc2cc(c3ccccc3)c(nc2n1)N4CC=CC4
SMILES OpenEye OEToolkits 1.5.0 c1ccc(cc1)c2cc3cnc(nc3nc2N4CC=CC4)N
Canonical SMILES CACTVS 3.341 Nc1ncc2cc(c3ccccc3)c(nc2n1)N4CC=CC4
Canonical SMILES OpenEye OEToolkits 1.5.0 c1ccc(cc1)c2cc3cnc(nc3nc2N4CC=CC4)N

IUPAC InChI

InChI=1S/C17H15N5/c18-17-19-11-13-10-14(12-6-2-1-3-7-12)16(20-15(13)21-17)22-8-4-5-9-22/h1-7,10-11H,8-9H2,(H2,18,19,20,21)

IUPAC InChI key

QFWNOFXQNCLFBC-UHFFFAOYSA-N
LZL

wwPDB Information

Atom count

37 (22 without Hydrogen)

Polymer type

Bound ligand

Type description

non-polymer

Type code

Is modified

No

Standard parent

Not Assigned

Defined at

2008-10-02

Last modified at

2011-06-04

Status

Released

Obsoleted

Not Assigned