UCSF

ZINC15205010

Substance Information

In ZINC since Heavy atoms Benign functionality
July 21st, 2008 15 No

CAS Numbers: 138472-01-2 , 163180-49-2

Other Names:

FK-409

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) 0.11 -0.63 -10.35 3 7 0 122 215.209 5

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50592-5-O Oryctolagus Cuniculus (cluster #5 Of 8), Other Other 150 0.64 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z50592 Z50592 Oryctolagus Cuniculus 150 0.64 Functional ≤ 10μM

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