UCSF

ZINC00000969

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 19 Yes

Popular Name: 9-(2-Chloro-6-fluorobenzyl)-9H-purin-6-amine 9-(2-Chloro-6-fluorobenzyl)-9H-p…

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CAS Number: 55779-18-5

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) 2.64 -1.08 -9.39 2 5 0 69 277.69 2 ↓
Lo Low (pH 4.5-6) 2.64 -0.91 -28.22 3 5 1 70 278.698 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Purity 98% APIChem

Activity (Go SEA)

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