Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

UMK

Summary
Name:4-(4-BROMOPHENYL)PIPERIDIN-4-OL
Formula:C11 H14 Br N O
Formal charge:0
Formula weight:256.139 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.014-(4-bromophenyl)piperidin-4-ol
OpenEye OEToolkits1.7.64-(4-bromophenyl)piperidin-4-ol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01Brc1ccc(cc1)C2(O)CCNCC2
InChIInChI1.03InChI=1S/C11H14BrNO/c12-10-3-1-9(2-4-10)11(14)5-7-13-8-6-11/h1-4,13-14H,5-8H2
InChIKeyInChI1.03QNLXJYQUWCNYBH-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385OC1(CCNCC1)c2ccc(Br)cc2
SMILESCACTVS3.385OC1(CCNCC1)c2ccc(Br)cc2
SMILES_CANONICALOpenEye OEToolkits1.7.6c1cc(ccc1C2(CCNCC2)O)Br
SMILESOpenEye OEToolkits1.7.6c1cc(ccc1C2(CCNCC2)O)Br

223532

PDB entries from 2024-08-07

PDB statisticsPDBj update infoContact PDBjnumon