UCSF

ZINC66054676

Substance Information

In ZINC since Heavy atoms Benign functionality
August 18th, 2011 16 Yes

Other Names:

MFCD17926163

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) 0.93 4.65 -39.47 2 5 1 59 224.284 3
Mid Mid (pH 6-8) 0.93 4.21 -10.17 1 5 0 58 223.276 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.