UCSF

ZINC17819771

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2008 12 Yes

Popular Name: 2-Amino-4-hydroxypteridine 2-Amino-4-hydroxypteridine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 2236-60-4 , 938-42-1 , [2236-60-4]

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) -0.62 -0.01 -19.72 3 6 0 98 163.14 0 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
UniProt Database Links ACSE_MOOTH; AIOA_ALCFA; AIOA_HERAR; DHP1_CORGT; DHP1_ECOLX; DHP1_MYCFO; DHP1_PSEAI; DHP2_ECOLX; DHP2_SHIFL; DHPS1_MYCBO; DHPS1_MYCLE; DHPS1_MYCTU; DHPS2_MYCBO; DHPS2_MYCLE; DHPS2_MYCTU; DHPS_BACSU; DHPS_CLOB8; DHPS_ECOL6; DHPS_ECOLI; DHPS_HAEIN; DHPS_NEIM ChEBI
PUBCHEM_PATENT_ID EP0739898A2; EP0837063A1; EP0882031A1; EP0937041A1; US5641783; US5670507; US5750575; US5777117; US5824677; US5856331; US5874553; US5985926; US6114335; US6127346; US6127423; WO1995012396A1; WO1995013075A1; WO1995013808A1; WO1995019171A1; WO1996030342A1; WO IBM Patent Data
Patent Database Links EP0884317; US2005085557; WO2005023830; WO2005049614 ChEBI

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
TGT-2-B Queuine TRNA-ribosyltransferase (cluster #2 Of 2), Bacterial Bacteria 600 0.73 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
TGT_ZYMMO P28720 TRNA-guanine Transglycosylase, Zymmo 600 0.73 Binding ≤ 1μM
TGT_ZYMMO P28720 TRNA-guanine Transglycosylase, Zymmo 600 0.73 Binding ≤ 10μM

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

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