U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C18H17BrN4O3
Molecular Weight 417.257
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CROLIBULIN

SMILES

COC1=CC(=CC(Br)=C1OC)[C@@H]2C3=CC=C(N)C(N)=C3OC(N)=C2C#N

InChI

InChIKey=JXONINOYTKKXQQ-CQSZACIVSA-N
InChI=1S/C18H17BrN4O3/c1-24-13-6-8(5-11(19)17(13)25-2)14-9-3-4-12(21)15(22)16(9)26-18(23)10(14)7-20/h3-6,14H,21-23H2,1-2H3/t14-/m1/s1

HIDE SMILES / InChI

Molecular Formula C18H17BrN4O3
Molecular Weight 417.257
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Crolibulin is a tubulin-disrupting agent, interacting at the colchicine-binding site, developed by EpiCept Corporation (which was later acquired by Immune Pharmaceuticals). The compound exhibits anti-cancer effect by vascular disruption and inhibition of apoptosis. In preclinical animal tumor models, combination therapy with crolibulin has demonstrated the synergistic activity with cytotoxic drugs as well as anti-angiogenic drugs, such as Avastin. The drug was investigated in clinical trials for the treatment of anaplastic thyroid cancer and has demonstrated a positive effect.

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:01:59 GMT 2023
Edited
by admin
on Sat Dec 16 18:01:59 GMT 2023
Record UNII
9ENT43KY91
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CROLIBULIN
INN   USAN   WHO-DD  
INN   USAN  
Official Name English
crolibulin [INN]
Common Name English
EPC2407
Code English
Crolibulin [WHO-DD]
Common Name English
EPC-2407
Code English
CROLIBULIN [USAN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C67421
Created by admin on Sat Dec 16 18:01:59 GMT 2023 , Edited by admin on Sat Dec 16 18:01:59 GMT 2023
Code System Code Type Description
CAS
1000852-17-4
Created by admin on Sat Dec 16 18:01:59 GMT 2023 , Edited by admin on Sat Dec 16 18:01:59 GMT 2023
PRIMARY
PUBCHEM
23649181
Created by admin on Sat Dec 16 18:01:59 GMT 2023 , Edited by admin on Sat Dec 16 18:01:59 GMT 2023
PRIMARY
DRUG BANK
DB12925
Created by admin on Sat Dec 16 18:01:59 GMT 2023 , Edited by admin on Sat Dec 16 18:01:59 GMT 2023
PRIMARY
USAN
WW-57
Created by admin on Sat Dec 16 18:01:59 GMT 2023 , Edited by admin on Sat Dec 16 18:01:59 GMT 2023
PRIMARY
SMS_ID
300000034069
Created by admin on Sat Dec 16 18:01:59 GMT 2023 , Edited by admin on Sat Dec 16 18:01:59 GMT 2023
PRIMARY
ChEMBL
CHEMBL2103852
Created by admin on Sat Dec 16 18:01:59 GMT 2023 , Edited by admin on Sat Dec 16 18:01:59 GMT 2023
PRIMARY
EPA CompTox
DTXSID10142925
Created by admin on Sat Dec 16 18:01:59 GMT 2023 , Edited by admin on Sat Dec 16 18:01:59 GMT 2023
PRIMARY
FDA UNII
9ENT43KY91
Created by admin on Sat Dec 16 18:01:59 GMT 2023 , Edited by admin on Sat Dec 16 18:01:59 GMT 2023
PRIMARY
NCI_THESAURUS
C66938
Created by admin on Sat Dec 16 18:01:59 GMT 2023 , Edited by admin on Sat Dec 16 18:01:59 GMT 2023
PRIMARY
INN
9247
Created by admin on Sat Dec 16 18:01:59 GMT 2023 , Edited by admin on Sat Dec 16 18:01:59 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY