General Information of the Compound
Compound ID
CP0522118
Compound Name
2-hydroxy-7-phenyl-6,11-dihydro-5H-benzo[a]carbazole-3-carboxylic acid
    Show/Hide
Structure
Formula
C23H17NO3
Molecular Weight
355.393
Canonical SMILES
OC(=O)c1cc2CCc3c([nH]c4cccc(-c5ccccc5)c34)-c2cc1O
    Show/Hide
InChI
InChI=1S/C23H17NO3/c25-20-12-17-14(11-18(20)23(26)27)9-10-16-21-15(13-5-2-1-3-6-13)7-4-8-19(21)24-22(16)17/h1-8,11-12,24-25H,9-10H2,(H,26,27)
    Show/Hide
InChIKey
MARNUACHJBLVOP-UHFFFAOYSA-N
Physicochemical Property
logP
5.0043
Rotatable Bonds
2
Heavy Atom Count
27
Polar Areas
73.32
Hydrogen Bond Donor Count
3
Hydrogen Bond Acceptor Count
2
Complexity
27

"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).

    Show/Hide
Click to Show/Hide the External Link(s) of This Compound
PubChem ID
CID: 44579559
ChEMBL ID
CHEMBL491804
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: PT06051, Thrombopoietin receptor
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000077 Ba/F3 Mus musculus (Mouse)  1
1
EC50 > 30000 nM
   TI
   LI
   LO
   TS