UCSF

ZINC00157126

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 11 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) 2.29 1.7 -7.26 0 1 0 17 168.623 2

Vendor Notes

Note Type Comments Provided By
Boiling_Point 102-103?/3mm Alfa-Aesar
Boiling_Point 102-103°/3mm Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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