UCSF

ZINC33882281

Substance Information

In ZINC since Heavy atoms Benign functionality
July 31st, 2009 11 Yes

Other Names:

LS-119916

MFCD12190273

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) -0.22 1.64 -129.68 6 2 2 55 152.241 3
Mid Mid (pH 6-8) -0.22 1.2 -36.35 5 2 1 54 151.233 3

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% )