Compound ID	CP0032210
Compound Name	4-(4-piperidin-4-ylphenyl)-7-[4-(trifluoromethyl)phenyl]naphthalene-2-carboxylic acid     Show/Hide
Synonyms	4-((piperindin-4-yl)-phenyl)-(7-(4-(trifluoromethyl)-phenyl)-2-naphthoic acid PPTN     Show/Hide
Structure
Formula	C29H24F3NO2
Molecular Weight	475.51
Canonical SMILES	OC(=O)c1cc(-c2ccc(cc2)C2CCNCC2)c2ccc(cc2c1)-c1ccc(cc1)C(F)(F)F     Show/Hide
InChI	InChI=1S/C29H24F3NO2/c30-29(31,32)25-8-5-19(6-9-25)22-7-10-26-23(15-22)16-24(28(34)35)17-27(26)21-3-1-18(2-4-21)20-11-13-33-14-12-20/h1-10,15-17,20,33H,11-14H2,(H,34,35)     Show/Hide
InChIKey	FOECKIWHCOYYFL-UHFFFAOYSA-N
Physicochemical Property	logP 7.3578 Rotatable Bonds 4 Heavy Atom Count 35 Polar Areas 49.33 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 2 Complexity 35 "RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count).     Show/Hide
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PubChem ID	CID: 42611190 SID: 81046076
ChEMBL ID	CHEMBL1800685

Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity