General
Preferred name
CASPOFUNGIN
Synonyms
Caspofungin Acetate ()
L-743,872 ()
Cancidas ()
MK-991 ()
L-743872 ()
MK-0991 ()
Caspofungin diacetate ()
P&D ID
PD009981
CAS
162808-62-0
Tags
natural product
drug
available
Drug indication
Fungal infection
Drug Status
approved
Max Phase
Phase 4
First approval
2001
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Cell lines
0
Organisms
9
Compound Sets
5
ChEMBL Approved Drugs
ChEMBL Drugs
DrugMAP
DrugMAP Approved Drugs
Other bioactive compounds
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
33
Properties
(calculated by RDKit )
Molecular Weight
1092.64
Hydrogen Bond Acceptors
18
Hydrogen Bond Donors
16
Rotatable Bonds
23
Ring Count
4
Aromatic Ring Count
1
cLogP
-3.31
TPSA
412.03
Fraction CSP3
0.75
Chiral centers
16.0
Largest ring
21.0
QED
0.05
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Therapeutic Class
Antifungal Agents
Source data
