UCSF

ZINC03780965

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2005 32 Yes

Popular Name: FGIN-1-27 FGIN-1-27

Find On: PubMed — Wikipedia — Google

CAS Number: 142720-24-9

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) 8.30 16.88 -9.65 1 3 0 36 436.615 13 ↓

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
TSPO-1-E Peripheral-type Benzodiazepine Receptor (cluster #1 Of 1), Eukaryotic Eukaryotes 10 0.35 Binding ≤ 10μM
TSPOA-1-E Translocator Protein (cluster #1 Of 1), Eukaryotic Eukaryotes 4 0.37 Binding ≤ 10μM
Z50425-3-O Plasmodium Falciparum (cluster #3 Of 22), Other Other 3981 0.24 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
TSPO_MOUSE P50637 Peripheral-type Benzodiazepine Receptor, Mouse 10 0.35 Binding ≤ 1μM
TSPO_RAT P16257 Peripheral-type Benzodiazepine Receptor, Rat 10 0.35 Binding ≤ 1μM
TSPOA_HUMAN P30536 Translocator Protein, Human 4 0.37 Binding ≤ 1μM
TSPO_MOUSE P50637 Peripheral-type Benzodiazepine Receptor, Mouse 10 0.35 Binding ≤ 10μM
TSPO_RAT P16257 Peripheral-type Benzodiazepine Receptor, Rat 10 0.35 Binding ≤ 10μM
TSPOA_HUMAN P30536 Translocator Protein, Human 4 0.37 Binding ≤ 10μM
Z50425 Z50425 Plasmodium Falciparum 3162.27766 0.24 Functional ≤ 10μM

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

No pre-computed analogs available. Try a structural similarity search.