General
Preferred name
Piperidine sulfonamide
Synonyms
P&D ID
PD129798
CAS
4108-90-1
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)
DESCRIPTION Piperidine sulfonamide inhibits carbonic anhydrase 1,2. (Enamine Bioactive Compounds)
Compound Sets
2
Enamine Bioactive Compounds
Novartis Chemogenetic Library (NIBR MoA Box)
External IDs
15
Properties
(calculated by RDKit )
Molecular Weight
164.06
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
1
Rotatable Bonds
1
Ring Count
1
Aromatic Ring Count
0
cLogP
-0.32
TPSA
63.4
Fraction CSP3
1.0
Chiral centers
0.0
Largest ring
6.0
QED
0.58
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Member status
virtual
MOA
Carbonic anhydrase inhibitor
Angiogenesis Inhibitors
Apoptosis Inducers
Nicotinamide Phosphoribosyltransferase (NMPRTase) Inhibitors
"Carbonic anhydrase inhibitor
Nicotinamide Phosphoribosyltransferase (NMPRTase) Inhibitors"
Source data