ACE
(Z)-N-[2-(2-aminoethoxy)ethyl]-3-(1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-yl)-2-cyanoprop-2-enamide
Molecular Identity
ACE
(Z)-N-[2-(2-aminoethoxy)ethyl]-3-(1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-yl)-2-cyanoprop-2-enamide
PubChem CID: 171396576
2D Structure
Properties
C20H26N4O2
Molecular Formula
354.40
Molecular Weight
g/mol
354.2056
Exact Mass
Da
1.4
XLogP
Drug-like (Lipinski: < 5)
91.4
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
5
H-Bond Acceptors
547
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(2)
ACECS-1098815
Data from PubChem (NCBI)
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