UCSF

ZINC02539744

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 8 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) -4.97 1.24 -25.22 4 4 1 53 115.16 0

Vendor Notes

Note Type Comments Provided By
Melting_Point 201-204? Alfa-Aesar
Melting_Point 201-204° Alfa-Aesar

Activity (Go SEA)

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

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