UCSF

ZINC27638049

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 18th, 2009 11 No

Popular Name: CI-979 CI-979

Find On: PubMed — Wikipedia — Google

CAS Numbers: 139886-04-7 , 139886-32-1

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.76 2.29 -4.28 0 3 0 25 154.213 2 ↓

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z104303-3-O Muscarinic Acetylcholine Receptor (cluster #3 Of 7), Other Other 110 0.89 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z104303 Z104303 Muscarinic Acetylcholine Receptor 110 0.89 Binding ≤ 1μM
Z104303 Z104303 Muscarinic Acetylcholine Receptor 110 0.89 Binding ≤ 10μM

Analogs ( Draw Identity 99% 90% 80% 70% )