UCSF

ZINC53993790

Substance Information

In ZINC since Heavy atoms Benign functionality
November 28th, 2010 10 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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) -0.57 -2.28 -5.6 2 4 0 59 145.158 2

Vendor Notes

Note Type Comments Provided By
MP 148 - 150 Enamine Building Blocks
MP 148...150 Enamine Building Blocks
MP 156 - 160 Enamine Building Blocks
MP 157 - 159 Enamine Building Blocks
MP 157...159 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

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