LGD-6972

Search structure
Synonyms:
Status: Phase 1
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 6IJ842I0Z2

Structure
InChI Key HKJMCBYPVCGZFB-LDLOPFEMSA-N
Smile Cc1cc(C)c(-c2ccc(NC(=O)[C@H](Cc3ccc(C(=O)NCCS(=O)(=O)O)cc3)c3ccc(-c4ccc(C(C)(C)C)cc4)cc3)cc2)c(C)c1
InChI
InChI=1S/C43H46N2O5S/c1-28-25-29(2)40(30(3)26-28)35-17-21-38(22-18-35)45-42(47)39(27-31-7-9-36(10-8-31)41(46)44-23-24-51(48,49)50)34-13-11-32(12-14-34)33-15-19-37(20-16-33)43(4,5)6/h7-22,25-26,39H,23-24,27H2,1-6H3,(H,44,46)(H,45,47)(H,48,49,50)/t39-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C43H46N2O5S
Molecular Weight 702.92
AlogP 8.83
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 11.0
Polar Surface Area 112.57
Molecular species ACID
Aromatic Rings 5.0
Heavy Atoms 51.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Diabetes Mellitus, Type 2 2 D003924 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 1207989-09-0
ChEMBL CHEMBL4297469
DrugBank DB14779
FDA SRS 6IJ842I0Z2
PubChem 44625560
SureChEMBL SCHEMBL13494501
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