Compound Synopsis
Compound Overview
Bioactivity Data Summary
Protein Affinity Profile
Cellline Sensitivity Profile

291 - Overview - Compound Synopsis

Synonyms
ETONOGESTRELEtonogestrel
ImplanonNEXPLANON
NexplanonNuvaring
ORG 3236ORG-3236
Molecular Formula
C22H28O2
InChI
InChI=1S/C22H28O2/c1-4-21-13-14(3)20-17-9-7-16(23)12-15(17)6-8-18(20)19(21)10-11-22(21,24)5-2/h2,12,17-20,24H,3-4,6-11,13H2,1H3/t17-,18-,19-,20+,21-,22-/m0/s1
Smiles
C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3C(=C)C[C@@]21CC
Cross References
UniChem299397
canSAR291
ChEMBLCHEMBL1531
BindingDB50423516
Commercially Available
Unknown
Protein Targets


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 324.2089301364.04871252No