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BioLiP

PDB CCD ID: E2F
Number of entries in BioLiP: 1
Chemical formula: C19 H21 Cl N2 O
InChI: InChI=1S/C19H21ClN2O/c20-15-5-6-19-17(13-15)22(12-9-14-7-10-21-11-8-14)16-3-1-2-4-18(16)23-19/h1-6,13-14,21H,7-12H2
InChIKey: FAAYNSPZJRWJJC-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385Clc1ccc2Oc3ccccc3N(CCC4CCNCC4)c2c1
OpenEye OEToolkits 2.0.7c1ccc2c(c1)N(c3cc(ccc3O2)Cl)CCC4CCNCC4
Name:2-chloranyl-10-(2-piperidin-4-ylethyl)phenoxazine
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).

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