UCSF

ZINC66054678

Substance Information

In ZINC since Heavy atoms Benign functionality
August 18th, 2011 21 Yes

Other Names:

MFCD17926164

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) 1.99 6.74 -33.79 3 6 1 73 293.391 3
Mid Mid (pH 6-8) 1.99 6.38 -6.74 2 6 0 72 292.383 3

Vendor Notes

Note Type Comments Provided By
Purity 97% Fluorochem

Activity (Go SEA)

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

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