UCSF

ZINC00403220

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 12 No

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) 1.32 5.17 -7.16 0 4 0 53 172.18 6

Vendor Notes

Note Type Comments Provided By
Boiling_Point 207? Alfa-Aesar
Boiling_Point 207° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 98% Fluorochem
Melting_Point <-80? Alfa-Aesar
Melting_Point <-80° Alfa-Aesar

Activity (Go SEA)

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