General Information of Drug (ID: DM6E6CT)

Drug Name
OCID-4681
Synonyms
OCID-A; OCID-X; OCID-Y; HDAC inhibitors (cancer/fungal infection); HDAC inhibitors (cancer/fungal infection), OrchidResearch Laboratories; Histone deacetylase inhibitors (cancer/fungal infection), Orchid Research Laboratories; OCID-4681-S-01
Indication
Disease Entry ICD 11 Status REF
Solid tumour/cancer 2A00-2F9Z Investigative [1]
Structure
3D MOL 2D MOL
Chemical Identifiers
Formula
C25H22FN3O2
Canonical SMILES
C1CC1NC(=O)C(=CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N)C4=CC=C(C=C4)F
InChI
1S/C25H22FN3O2/c26-19-11-9-17(10-12-19)21(25(31)28-20-13-14-20)15-16-5-7-18(8-6-16)24(30)29-23-4-2-1-3-22(23)27/h1-12,15,20H,13-14,27H2,(H,28,31)(H,29,30)/b21-15+
InChIKey
PSMVQVNDYRGHCI-RCCKNPSSSA-N
Cross-matching ID
PubChem CID
25242439
CAS Number
1147868-26-5
TTD ID
D0QV3O

References

1 The ChEMBL database in 2017. Nucleic Acids Res. 2017 Jan 4;45(D1):D945-D954.