General Information of the Compound
Compound ID
CP0766690
Compound Name
SID24785492
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Structure
Formula
C15H14N2O3
Molecular Weight
270.288
Canonical SMILES
CC(=O)c1ccc(NC(=O)c2noc3c2CCC3)cc1
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InChI
InChI=1S/C15H14N2O3/c1-9(18)10-5-7-11(8-6-10)16-15(19)14-12-3-2-4-13(12)20-17-14/h5-8H,2-4H2,1H3,(H,16,19)
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InChIKey
IKFPLCJKATWICF-UHFFFAOYSA-N
Physicochemical Property
logP
2.6182
Rotatable Bonds
3
Heavy Atom Count
20
Polar Areas
72.2
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
4
Complexity
20

"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: 16188851
ChEMBL ID
CHEMBL1307933
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: PT06101, Latent membrane protein 1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
AC50 = 41080 nM
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