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UZP

Summary
Name:(3R)-3-(2,4-dichlorophenyl)-N~1~-hydroxy-N~5~-pentylpentanediamide
Formula:C16 H22 Cl2 N2 O3
Formal charge:0
Formula weight:361.263 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.01(3R)-3-(2,4-dichlorophenyl)-N~1~-hydroxy-N~5~-pentylpentanediamide
OpenEye OEToolkits2.0.7(3~{R})-3-(2,4-dichlorophenyl)-~{N}-oxidanyl-~{N}'-pentyl-pentanediamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c1c(cc(c(C(CC(=O)NCCCCC)CC(=O)NO)c1)Cl)Cl
InChIInChI1.03InChI=1S/C16H22Cl2N2O3/c1-2-3-4-7-19-15(21)8-11(9-16(22)20-23)13-6-5-12(17)10-14(13)18/h5-6,10-11,23H,2-4,7-9H2,1H3,(H,19,21)(H,20,22)/t11-/m1/s1
InChIKeyInChI1.03FHIDAHOTTVOIDA-LLVKDONJSA-N
SMILES_CANONICALCACTVS3.385CCCCCNC(=O)C[C@H](CC(=O)NO)c1ccc(Cl)cc1Cl
SMILESCACTVS3.385CCCCCNC(=O)C[CH](CC(=O)NO)c1ccc(Cl)cc1Cl
SMILES_CANONICALOpenEye OEToolkits2.0.7CCCCCNC(=O)C[C@H](CC(=O)NO)c1ccc(cc1Cl)Cl
SMILESOpenEye OEToolkits2.0.7CCCCCNC(=O)CC(CC(=O)NO)c1ccc(cc1Cl)Cl

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PDB entries from 2024-07-17

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