UCSF

ZINC02156450

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 17 Yes

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) 4.28 1.96 -5.88 0 1 0 4 221.303 2

Vendor Notes

Note Type Comments Provided By
BP 209 / 19 TCI
MP 85 - 87 Enamine Building Blocks
Melting_Point 85-86? Alfa-Aesar
Melting_Point 85-86° Alfa-Aesar
MP 85...87 Enamine Building Blocks
MP 86 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 96.0% min (HPLC) APIChem

Activity (Go SEA)

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