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Summary

Name:	8-methyl-6-phenoxy-2-(tetrahydro-2H-pyran-4-ylamino)pyrido[2,3-d]pyrimidin-7(8H)-one
Formula:	C19 H20 N4 O3
Formal charge:	0
Formula weight:	352.387 Da
Component type:	NON-POLYMER

Chemical Identifiers

Program	Version	Name
ACDLabs	10.04	8-methyl-6-phenoxy-2-(tetrahydro-2H-pyran-4-ylamino)pyrido[2,3-d]pyrimidin-7(8H)-one
OpenEye OEToolkits	1.5.0	8-methyl-2-(oxan-4-ylamino)-6-phenoxy-pyrido[6,5-d]pyrimidin-7-one

Chemical Descriptors

Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C3N(c1nc(ncc1C=C3Oc2ccccc2)NC4CCOCC4)C
SMILES_CANONICAL	CACTVS	3.341	CN1C(=O)C(=Cc2cnc(NC3CCOCC3)nc12)Oc4ccccc4
SMILES	CACTVS	3.341	CN1C(=O)C(=Cc2cnc(NC3CCOCC3)nc12)Oc4ccccc4
SMILES_CANONICAL	OpenEye OEToolkits	1.5.0	CN1c2c(cnc(n2)NC3CCOCC3)C=C(C1=O)Oc4ccccc4
SMILES	OpenEye OEToolkits	1.5.0	CN1c2c(cnc(n2)NC3CCOCC3)C=C(C1=O)Oc4ccccc4
InChI	InChI	1.03	InChI=1S/C19H20N4O3/c1-23-17-13(11-16(18(23)24)26-15-5-3-2-4-6-15)12-20-19(22-17)21-14-7-9-25-10-8-14/h2-6,11-12,14H,7-10H2,1H3,(H,20,21,22)
InChIKey	InChI	1.03	MQCPQHIQHJWGCZ-UHFFFAOYSA-N

218853

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