UCSF

ZINC00198959

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 23 Yes

Other Names:

MFCD00398957

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) 3.36 0.75 -7.3 2 3 0 46 308.425 1

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
FSHR-1-E Follicle Stimulating Hormone Receptor (cluster #1 Of 1), Eukaryotic Eukaryotes 4400 0.33 Functional ≤ 10μM
Z80092-2-O CHO-K1 (Ovarian Cells) (cluster #2 Of 2), Other Other 4400 0.33 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z80092 Z80092 CHO-K1 (Ovarian Cells) 4400 0.33 Functional ≤ 10μM
FSHR_HUMAN P23945 Follicle Stimulating Hormone Receptor, Human 4400 0.33 Functional ≤ 10μM

Reactome Annotations from Targets (via Uniprot)

Description Species
G alpha (s) signalling events
Hormone ligand-binding receptors

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