General Information of the Compound
Compound ID
CP0180509
Compound Name
2-(3-fluoro-4-phenylphenyl)acetic acid
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Structure
Formula
C14H11FO2
Molecular Weight
230.238
Canonical SMILES
OC(=O)Cc1ccc(c(F)c1)-c1ccccc1
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InChI
InChI=1S/C14H11FO2/c15-13-8-10(9-14(16)17)6-7-12(13)11-4-2-1-3-5-11/h1-8H,9H2,(H,16,17)
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InChIKey
ZLLZRKQQNGBXRD-UHFFFAOYSA-N
Physicochemical Property
logP
3.1198
Rotatable Bonds
3
Heavy Atom Count
17
Polar Areas
37.3
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
Complexity
17

"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).

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PubChem ID
CID: 11831237
SID: 16948862
ChEMBL ID
CHEMBL2152245