UCSF

ZINC08994439

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2007 21 Yes

CAS Number: 26130-02-9

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) 3.73 6.17 -14.9 2 5 0 63 299.355 3
Ref Reference (pH 7) 4.66 5.32 -8.97 2 5 0 66 299.355 2

Vendor Notes

Note Type Comments Provided By
biological_use . ZereneX Building Blocks
biological_use Antiviral agent IBScreen Bioactives IBScreen Bioactives
biological_use Cytostatic IBScreen Bioactives
mechanism Immunoregulant IBScreen Bioactives

Activity (Go SEA)

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