General Information of the Compound
Compound ID
CP0467223
Compound Name
(Z)-5-(4-(morpholinomethyl)benzylidene)-3-(4-phenoxyphenyl)imidazolidine-2,4-dione
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Structure
Formula
C27H25N3O4
Molecular Weight
455.514
Canonical SMILES
O=C1N\C(=C/c2ccc(CN3CCOCC3)cc2)C(=O)N1c1ccc(Oc2ccccc2)cc1
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InChI
InChI=1S/C27H25N3O4/c31-26-25(18-20-6-8-21(9-7-20)19-29-14-16-33-17-15-29)28-27(32)30(26)22-10-12-24(13-11-22)34-23-4-2-1-3-5-23/h1-13,18H,14-17,19H2,(H,28,32)/b25-18-
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InChIKey
LQNWLKCBKLOFQL-BWAHOGKJSA-N
Physicochemical Property
logP
4.4084
Rotatable Bonds
6
Heavy Atom Count
34
Polar Areas
71.11
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
5
Complexity
34

"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: 15983863
SID: 24262879
ChEMBL ID
CHEMBL392402
Map of Molecular Bioactivity Related to the Compound
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
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01027, Melanin-concentrating hormone receptor 1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
Ki > 5000 nM
   TI
   LI
   LO
   TS