S-EMCA [7280]



S-EMCA


SMILES CC[C@H]1[C@@H](O)[C@@H]2[C@H](C[C@H](O)[C@]3(C)[C@@H]([C@H](C)C[C@H](C)C(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
InChIKey NPBCMXATLRCCLF-IRRLEISYSA-N

Chemical Properties

Hydrogen bond acceptors 4
Hydrogen bond donors 4
Rotatable bonds 5
Log P 4.331
Molecular weight (Da) 450.3
Stereochemistry info partial

Database connections

Structure pdb 7CFN 7CFN

Bioactivities

Receptor Activity Source
Protein Gene Species Family Class Type Min Avg Max Database
Receptor Activity Source
Protein Gene Species Family Class Type Min Avg Max Database

S-EMCA


Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Distribution across phases (no. indications)

Phase I 0
Phase II 0
Phase III 0
Phase IV 0

Database connections

Structure pdb 7CFN 7CFN

Compound is not listed as a drug.