General Information of the Compound
Compound ID
CP0417258
Compound Name
N-(3-carbazol-9-yl-2-hydroxypropyl)-N-cyclobutylmethanesulfonamide
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Structure
Formula
C20H24N2O3S
Molecular Weight
372.49
Canonical SMILES
CS(=O)(=O)N(CC(O)Cn1c2ccccc2c2ccccc12)C1CCC1
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InChI
InChI=1S/C20H24N2O3S/c1-26(24,25)22(15-7-6-8-15)14-16(23)13-21-19-11-4-2-9-17(19)18-10-3-5-12-20(18)21/h2-5,9-12,15-16,23H,6-8,13-14H2,1H3
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InChIKey
PJPRYDGDPQCJSJ-UHFFFAOYSA-N
Physicochemical Property
logP
2.9695
Rotatable Bonds
6
Heavy Atom Count
26
Polar Areas
62.54
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
4
Complexity
26

"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: 89900897
ChEMBL ID
CHEMBL3752819
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: PT06468, Period circadian protein homolog 2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000043 U2OS Homo sapiens (Human)  1
1
EC50 = 129 nM
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