UCSF

ZINC20056622

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2008 10 Yes

Other Names:

MFCD09953139

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) 0.86 4.09 -39.11 2 3 1 43 146.21 6
Mid Mid (pH 6-8) 0.86 2.7 -4.74 1 3 0 38 145.202 6

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% )