UCSF

ZINC36721034

Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2009 16 Yes

Other Names:

MFCD11133087

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) 0.32 0.98 -44.28 4 4 1 68 229.344 4
Hi High (pH 8-9.5) 0.32 0.69 -7.77 3 4 0 67 228.336 4

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% )