General
Preferred name
CYCLOMETHYLTRYPTOPHAN
Synonyms
Lycoperodine-1 ()
TNCA ()
3-Carboxy-1,2,3,4-tetrahydro-2-carboline ()
P&D ID
PD158986
CAS
42438-90-4
6052-68-2
Tags
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
PRICE 29
DESCRIPTION 3-Carboxy-1,2,3,4-tetrahydro-2-carboline shows inhibitory activity against thrombin. (Enamine Bioactive Compounds)
DESCRIPTION TNCA (Lycoperodine-1) is a high-affinity CaSR ligand (CaSRL) with co-agonist activity. (TargetMol Bioactive Compound Library)
Cell lines
1
Organisms
0
Compound Sets
3
Enamine Bioactive Compounds
EBC-04189
MedChem Express Bioactive Compound Library
HY-121584
TargetMol Bioactive Compound Library
T7716
External IDs
20
Properties
(calculated by RDKit )
Molecular Weight
216.09
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
3
Rotatable Bonds
1
Ring Count
3
Aromatic Ring Count
2
cLogP
1.27
TPSA
65.12
Fraction CSP3
0.25
Chiral centers
1.0
Largest ring
6.0
QED
0.67
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
CaSR
Pathway
GPCR/G protein
Source data