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Summary

Name:	N-[(3M)-3-{6-[(3R)-3-methoxyoxolan-3-yl]pyridin-2-yl}-1-methyl-1H-pyrrolo[2,3-c]pyridin-5-yl]urea
Formula:	C19 H21 N5 O3
Formal charge:	0
Formula weight:	367.402 Da
Component type:	non-polymer

Chemical Identifiers

Program	Version	Name
ACDLabs	12.01	N-[(3M)-3-{6-[(3R)-3-methoxyoxolan-3-yl]pyridin-2-yl}-1-methyl-1H-pyrrolo[2,3-c]pyridin-5-yl]urea
OpenEye OEToolkits	2.0.7	1-[3-[6-[(3~{R})-3-methoxyoxolan-3-yl]pyridin-2-yl]-1-methyl-pyrrolo[2,3-c]pyridin-5-yl]urea

Chemical Descriptors

Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	COC1(CCOC1)c1nc(ccc1)c1cn(C)c2cnc(NC(N)=O)cc21
InChI	InChI	1.06	InChI=1S/C19H21N5O3/c1-24-10-13(12-8-17(23-18(20)25)21-9-15(12)24)14-4-3-5-16(22-14)19(26-2)6-7-27-11-19/h3-5,8-10H,6-7,11H2,1-2H3,(H3,20,21,23,25)/t19-/m0/s1
InChIKey	InChI	1.06	LBFKCADAEOIHNK-IBGZPJMESA-N
SMILES_CANONICAL	CACTVS	3.385	CO[C@]1(CCOC1)c2cccc(n2)c3cn(C)c4cnc(NC(N)=O)cc34
SMILES	CACTVS	3.385	CO[C]1(CCOC1)c2cccc(n2)c3cn(C)c4cnc(NC(N)=O)cc34
SMILES_CANONICAL	OpenEye OEToolkits	2.0.7	Cn1cc(c2c1cnc(c2)NC(=O)N)c3cccc(n3)[C@@]4(CCOC4)OC
SMILES	OpenEye OEToolkits	2.0.7	Cn1cc(c2c1cnc(c2)NC(=O)N)c3cccc(n3)C4(CCOC4)OC

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