UCSF

ZINC36152404

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 26 No

Popular Name: [[[(1R,2E)-2-[(6-aminopurin-9-yl)methylene]cyclopropyl]methoxy-hydroxy-phosphoryl]-hydroxy-phosphory [[[(1R,2E)-2-[(6-aminopurin-9-yl…

Find On: PubMed — Wikipedia — Google

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

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Q72547-1-V Human Immunodeficiency Virus Type 1 Reverse Transcriptase (cluster #1 Of 6), Viral Viruses 10000 0.27 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Q72547_9HIV1 Q72547 Human Immunodeficiency Virus Type 1 Reverse Transcriptase, 9hiv1 10000 0.27 Binding ≤ 10μM

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