UCSF

ZINC04110201

Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2005 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) 2.65 0.36 -2.85 0 4 0 59 192.989 1

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks
MP 94 - 98 Enamine Building Blocks
Melting_Point 94-98? Alfa-Aesar
Melting_Point 94-98° Alfa-Aesar
MP 94...98 Enamine Building Blocks
purity 95 Enamine Building Blocks
Purity 97% Fluorochem

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.