UCSF

ZINC12503861

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2008 21 No

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) -2.97 -7 -146.58 3 12 -2 190 323.154 4

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Q8T6J6-1-E Orotidine Phosphate Decarboxylase (cluster #1 Of 1), Eukaryotic Eukaryotes 1000 0.40 Binding ≤ 10μM
PYRF-1-F Orotidine Phosphate Decarboxylase (cluster #1 Of 1), Fungal Fungi 64 0.48 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
PYRF_YEAST P03962 Orotidine Phosphate Decarboxylase, Yeast 64 0.48 Binding ≤ 1μM
Q8T6J6_PLAFA Q8T6J6 Orotidine Phosphate Decarboxylase, Plafa 1000 0.40 Binding ≤ 1μM
Q8T6J6_PLAFA Q8T6J6 Orotidine Phosphate Decarboxylase, Plafa 1000 0.40 Binding ≤ 10μM
PYRF_YEAST P03962 Orotidine Phosphate Decarboxylase, Yeast 64 0.48 Binding ≤ 10μM

Reactome Annotations from Targets (via Uniprot)

Description Species
Pyrimidine biosynthesis

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