GSK-625433

Search structure
Synonyms:
Status: Phase 1
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 2YAD6KT0NT

Structure
InChI Key HLQXYDHLDZTWDW-KAWPREARSA-N
Smile COC[C@H]1C[C@@](Cn2cccn2)(C(=O)O)N(C(=O)c2ccc(C(C)(C)C)c(OC)c2)[C@H]1c1nccs1
InChI
InChI=1S/C26H32N4O5S/c1-25(2,3)19-8-7-17(13-20(19)35-5)23(31)30-21(22-27-10-12-36-22)18(15-34-4)14-26(30,24(32)33)16-29-11-6-9-28-29/h6-13,18,21H,14-16H2,1-5H3,(H,32,33)/t18-,21-,26-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C26H32N4O5S
Molecular Weight 512.63
AlogP 4.02
Hydrogen Bond Acceptor 8.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 8.0
Polar Surface Area 106.78
Molecular species ACID
Aromatic Rings 3.0
Heavy Atoms 36.0

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL2024212
FDA SRS 2YAD6KT0NT
PubChem 11569786
SureChEMBL SCHEMBL5186945
CONTENTS