General
Preferred name
Amoxicillin trihydrate
Synonyms
Amoxycillin trihydrate ()
Amoxil trihydrate ()
Amoxipen trihydrate ()
Moxaline trihydrate ()
Amoxicillin sesquihydrate ()
Amoxil trihydrate, Amoxipen trihydrate, Moxaline trihydrate ()
Amoxicillin (hydrate) ()
P&D ID
PD017214
CAS
61336-70-7
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 Amoxicillin is a penicillin derivative used for the treatment of infections caused by gram-positive bacteria, in particular streptococcal bacteria causing upper respiratory tract infections. (Enamine Bioactive Compounds)
DESCRIPTION Amoxicillin trihydrate (Moxaline trihydrate) binds to and inactivates penicillin-binding protein (PBP) 1A located on the inner membrane of the bacterial cell wall. Amoxicillin trihydrate is a broad-spectrum, semisynthetic aminopenicillin antibiotic with bactericidal activity. Inactivation of PBPs interferes with the cross-linkage of peptidoglycan chains necessary for bacterial cell wall strength and rigidity. This interrupts bacterial cell wall synthesis and results in the weakening of the bacterial cell wall and causes cell lysis. (TargetMol Bioactive Compound Library)
Compound Sets
5
Cayman Chemical Bioactives
19188
Enamine Bioactive Compounds
EBC-15035
Enamine BioReference Compounds
Selleckchem Bioactive Compound Library
amoxicillin-trihydrate
TargetMol Bioactive Compound Library
T1005L
External IDs
15
Properties
(calculated by RDKit )
Molecular Weight
419.14
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
4
Rotatable Bonds
4
Ring Count
3
Aromatic Ring Count
1
cLogP
-2.45
TPSA
227.46
Fraction CSP3
0.44
Chiral centers
4.0
Largest ring
6.0
QED
0.38
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
antibiotic
Bacterial
PBPs
Antibiotics,Bacterial
Pathway
Microbiology/virology
Source data