UCSF

ZINC62568018

Substance Information

In ZINC since Heavy atoms Benign functionality
May 3rd, 2011 14 Yes

Other Names:

MFCD19285682

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) 0.39 3.32 -85.34 3 3 2 24 199.342 1
Hi High (pH 8-9.5) 0.39 1.97 -34.4 2 3 1 20 198.334 1

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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

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