UCSF

ZINC19735879

Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2008 9 Yes

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) 0.12 -0.97 -7.12 2 3 0 48 124.143 1

Vendor Notes

Note Type Comments Provided By
MP 87-88° Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks
MP 90-92° Oakwood Chemical
purity 95 Enamine Building Blocks
Purity 97% Fluorochem
Purity 98% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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