UCSF

ZINC43511472

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 14th, 2010 38 No

Popular Name: [(1R)-1-[(4-amino-2-oxo-pyrimidin-1-yl)methyl]-2-hydroxy-ethoxy]methyl-(3-hexadecoxypropoxy)phosphin [(1R)-1-[(4-amino-2-oxo-pyrimidi…

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Annotations

Vendors

    None

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) 5.33 9.73 -51.98 3 10 -1 149 560.693 26 ↓

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z101779-1-O Ectromelia Virus Moscow (cluster #1 Of 1), Other Other 125 0.25 Functional ≤ 10μM
Z102131-1-O Vaccinia Virus Copenhagen (cluster #1 Of 1), Other Other 800 0.22 Functional ≤ 10μM
Z102132-1-O Vaccinia Virus WR (cluster #1 Of 1), Other Other 130 0.25 Functional ≤ 10μM
Z50517-1-O Human Herpesvirus 5 Strain AD169 (cluster #1 Of 2), Other Other 1 0.33 Functional ≤ 10μM
Z50530-1-O Human Herpesvirus 5 (cluster #1 Of 5), Other Other 1 0.33 Functional ≤ 10μM
Z50599-1-O Cowpox Virus (cluster #1 Of 1), Other Other 600 0.23 Functional ≤ 10μM
Z50600-1-O Vaccinia Virus (cluster #1 Of 2), Other Other 80 0.26 Functional ≤ 10μM
Z50604-1-O Murid Herpesvirus 1 (cluster #1 Of 1), Other Other 1 0.33 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z50599 Z50599 Cowpox Virus 240 0.24 Functional ≤ 10μM
Z101779 Z101779 Ectromelia Virus Moscow 125 0.25 Functional ≤ 10μM
Z50530 Z50530 Human Herpesvirus 5 0.9 0.33 Functional ≤ 10μM
Z50517 Z50517 Human Herpesvirus 5 Strain AD169 0.9 0.33 Functional ≤ 10μM
Z50604 Z50604 Murid Herpesvirus 1 0.9 0.33 Functional ≤ 10μM
Z50600 Z50600 Vaccinia Virus 80 0.26 Functional ≤ 10μM
Z102131 Z102131 Vaccinia Virus Copenhagen 140 0.25 Functional ≤ 10μM
Z102132 Z102132 Vaccinia Virus WR 1100 0.22 Functional ≤ 10μM

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