EXICORILANT

Search structure


Synonyms:	Cort125281 CORT-125281 CORT125281 Exicorilant
Status:	Phase 1
Entry Type:	Small molecule
Molecule Category:	UNKNOWN
UNII:	GTB859B7K8

Structure


InChI Key	HWJYJKAURRIWJM-GKVSMKOHSA-N
Smile	Cn1ncc(S(=O)(=O)N2CC[C@H]3Cc4c(cnn4-c4ccc(F)cc4)C[C@]3(C(=O)c3cc(C(F)(F)F)ccn3)C2)n1
InChI	InChI=1S/C26H23F4N7O3S/c1-35-32-14-23(34-35)41(39,40)36-9-7-17-11-22-16(13-33-37(22)20-4-2-19(27)3-5-20)12-25(17,15-36)24(38)21-10-18(6-8-31-21)26(28,29)30/h2-6,8,10,13-14,17H,7,9,11-12,15H2,1H3/t17-,25-/m0/s1

Physicochemical Descriptors

Property Name	Value
Molecular Formula	C26H23F4N7O3S
Molecular Weight	589.58
AlogP	3.23
Hydrogen Bond Acceptor	9.0
Hydrogen Bond Donor	0.0
Number of Rotational Bond	5.0
Polar Surface Area	115.87
Molecular species	NEUTRAL
Aromatic Rings	4.0
Heavy Atoms	41.0

Pharmacology

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Transcription factor Nuclear receptor Nuclear hormone receptor subfamily 3 Nuclear hormone receptor subfamily 3 group C Nuclear hormone receptor subfamily 3 group C member 1	-	-	-	12	-

Indications

Mesh Heading	Maximum Phase	Mesh ID	Reference
Prostatic Neoplasms, Castration-Resistant	1	D064129	ClinicalTrials

Cross References

Resources	Reference
ChEMBL	CHEMBL4089731
DrugBank	DB16162
FDA SRS	GTB859B7K8
SureChEMBL	SCHEMBL16737057

CONTENTS