General
Preferred name
Hydroxocobalamin
Synonyms
P&D ID
PD126919
CAS
13422-51-0
Tags
available
contains metal
drug
Drug Status
approved
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 ]]
Compound Sets
4
AdooQ Bioactive Compound Library
DrugBank
DrugBank Approved Drugs
NCATS Inxight Approved Drugs
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
14
Properties
(calculated by RDKit )
Molecular Weight
1345.57
Hydrogen Bond Acceptors
17
Hydrogen Bond Donors
10
Rotatable Bonds
16
Ring Count
12
Aromatic Ring Count
2
cLogP
-0.22
TPSA
437.23
Fraction CSP3
0.63
Chiral centers
17.0
Largest ring
19.0
QED
0.1
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
