English 日本語简体中文繁體中文 한국어

✖

Menu

RCSB PDB PDBe BMRB Adv. Search Search help

Summary Geometry Related PDB entries

A1BP1

Summary

Name:	1-methyl-N-[(2R)-1-(1,3-oxazol-4-yl)propan-2-yl]-1H-indazole-3-carboxamide
Formula:	C15 H16 N4 O2
Formal charge:	0
Formula weight:	284.313 Da
Component type:	non-polymer

Chemical Identifiers

Program	Version	Name
ACDLabs	14.52	1-methyl-N-[(2R)-1-(1,3-oxazol-4-yl)propan-2-yl]-1H-indazole-3-carboxamide
OpenEye OEToolkits	3.1.0.0	1-methyl-~{N}-[(2~{S})-1-(1,3-oxazol-4-yl)propan-2-yl]indazole-3-carboxamide

Chemical Descriptors

Type	Program	Version	Descriptor
SMILES	ACDLabs	14.52	Cn1nc(C(=O)NC(C)Cc2cocn2)c2ccccc21
InChI	InChI	1.06	InChI=1S/C15H16N4O2/c1-10(7-11-8-21-9-16-11)17-15(20)14-12-5-3-4-6-13(12)19(2)18-14/h3-6,8-10H,7H2,1-2H3,(H,17,20)
InChIKey	InChI	1.06	LQNOWDAJBFJAFM-UHFFFAOYSA-N
SMILES_CANONICAL	CACTVS	3.385	C[C@@H](Cc1cocn1)NC(=O)c2nn(C)c3ccccc23
SMILES	CACTVS	3.385	C[CH](Cc1cocn1)NC(=O)c2nn(C)c3ccccc23
SMILES_CANONICAL	OpenEye OEToolkits	3.1.0.0	C[C@@H](Cc1cocn1)NC(=O)c2c3ccccc3n(n2)C
SMILES	OpenEye OEToolkits	3.1.0.0	CC(Cc1cocn1)NC(=O)c2c3ccccc3n(n2)C

248636

PDB entries from 2026-02-04

PDB statistics

PDBj update info

Contact PDBj

numon