7-KETO DEHYDROEPIANDROSTERONE

Search structure
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN

Structure
InChI Key KPRGOTLNGIBVFL-VYLIMTTQSA-N
Smile C[C@]12CCC3C(C(=O)C=C4C[C@@H](O)CC[C@@]43C)C1CCC2=O
InChI
InChI=1S/C19H26O3/c1-18-7-5-12(20)9-11(18)10-15(21)17-13-3-4-16(22)19(13,2)8-6-14(17)18/h10,12-14,17,20H,3-9H2,1-2H3/t12-,13?,14?,17?,18-,19-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H26O3
Molecular Weight 302.41
AlogP 3.06
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 0.0
Polar Surface Area 54.37
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 22.0

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL1875999
PubChem 9904502
SureChEMBL SCHEMBL12014455
CONTENTS