Synonyms:
Status: Phase 1
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: LSK1L593UU

Structure

InChI Key SRJNRAQUSAVENA-GSHUGGBRSA-N
Smile Cc1cccc2c1NC(=O)[C@@H](NC(=O)[C@H](CCC(F)(F)F)[C@H](CCC(F)(F)F)C(N)=O)N=C2c1cccc(F)c1
InChI
InChI=1S/C26H25F7N4O3/c1-13-4-2-7-18-19(13)36-24(40)22(35-20(18)14-5-3-6-15(27)12-14)37-23(39)17(9-11-26(31,32)33)16(21(34)38)8-10-25(28,29)30/h2-7,12,16-17,22H,8-11H2,1H3,(H2,34,38)(H,36,40)(H,37,39)/t16-,17+,22+/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C26H25F7N4O3
Molecular Weight 574.5
AlogP 4.77
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 9.0
Polar Surface Area 113.65
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 40.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Neoplasms 1 D009369 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 1584647-27-7
ChEMBL CHEMBL3911164
DrugBank DB13126
FDA SRS LSK1L593UU
PubChem 73388393
SureChEMBL SCHEMBL15608290