UCSF

ZINC00522918

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 14 No

Other Names:

MFCD00232783

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) 1.34 2.68 -10.56 0 4 0 60 189.17 2
Ref Reference (pH 7) 2.16 2.51 -9.98 1 4 0 63 189.17 1

Vendor Notes

Note Type Comments Provided By
melting_point 203 - 205 KeyOrganics
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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