MetaADEDB 2.0 @ LMMD
tert-butyl beta-carboline-3-carboxylate
(FVFFDKKTXYVCCW-UHFFFAOYSA-N)
Structure
SMILES
O=C(c1ncc2c(c1)c1ccccc1[nH]2)OC(C)(C)C
Molecular Formula:
C16H16N2O2
Molecular Weight:
268.310
Log P:
3.6714
Hydrogen Bond Acceptor:
3
Hydrogen Bond Donor:
1
TPSA:
54.98
CAS Number(s):
93835-05-3
Synonym(s)
1.
tert-butyl beta-carboline-3-carboxylate
2.
3-carbo-t-butoxy-beta-carboline
3.
3-carboxy-tert-butoxy-beta-carboline
4.
beta-CCT
5.
beta-CCtB
6.
beta-carboline-3-carboxylate t-butyl ester
7.
beta-carboline-3-carboxylate-t-butyl ester
External Link(s)
MeSHC043232
PubChem Compound124514
BindingDB50244036
50001479
CHEMBLCHEMBL307783
Therapeutic Target DatabaseD03PPZ
ZINC5353699
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Ataxia12404077CTD
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