General Information of the Compound
Compound ID
CP0963938
Compound Name
N-((3S,4R)-4-hydroxy-2-oxopyrrolidin-3-yl)-3-(2-phenyl-7-(prop-1-en-2-yl)-1H-indol-3-yl)propanamide
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Structure
Formula
C24H25N3O3
Molecular Weight
403.482
Canonical SMILES
C=C(C)c1cccc2c(CCC(=O)N[C@@H]3C(=O)NC[C@H]3O)c(-c3ccccc3)[nH]c12
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InChI
InChI=1S/C24H25N3O3/c1-14(2)16-9-6-10-17-18(21(27-22(16)17)15-7-4-3-5-8-15)11-12-20(29)26-23-19(28)13-25-24(23)30/h3-10,19,23,27-28H,1,11-13H2,2H3,(H,25,30)(H,26,29)/t19-,23+/m1/s1
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InChIKey
AUZVLAPCEHFHPL-XXBNENTESA-N
Physicochemical Property
logP
2.7761
Rotatable Bonds
6
Heavy Atom Count
30
Polar Areas
94.22
Hydrogen Bond Donor Count
4
Hydrogen Bond Acceptor Count
3
Complexity
30

"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: 155367063
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: PT07126, Apolipoprotein L1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000058 T-REx-293 Homo sapiens (Human)  1
1
IC50 = 250 nM
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