UCSF

ZINC05117282

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 21st, 2006 11 Yes

Popular Name: 2-Amino-1H-benzo[d]imidazol-5-ol 2-Amino-1H-benzo[d]imidazol-5-ol

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CAS Number: 51276-85-8

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) 0.73 0.83 -10.03 4 4 0 75 149.153 0 ↓
Ref Reference (pH 7) 0.73 1.3 -30.58 5 4 1 76 150.161 0 ↓
Mid Mid (pH 6-8) 0.73 2.05 -42.61 4 4 0 79 149.153 0 ↓
Mid Mid (pH 6-8) 0.73 0.83 -8.96 4 4 0 75 149.153 0 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
UROK-1-E Urokinase-type Plasminogen Activator (cluster #1 Of 4), Eukaryotic Eukaryotes 10000 0.64 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
UROK_HUMAN P00749 Urokinase-type Plasminogen Activator, Human 10000 0.64 Binding ≤ 10μM

Reactome Annotations from Targets (via Uniprot)

Description Species
Dissolution of Fibrin Clot

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

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