UCSF

ZINC02575691

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 25 No

CAS Numbers: 247021-90-5 , [247021-90-5]

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) 3.02 10.25 -50.66 0 6 -1 79 340.355 7

Vendor Notes

Note Type Comments Provided By
Purity >99% Fluorochem

Activity (Go SEA)

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

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