UCSF

ZINC01680671

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 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) -1.20 -4.31 -41.01 2 8 -1 135 172.076 0

Vendor Notes

Note Type Comments Provided By
Melting_Point 182-184? dec. Alfa-Aesar
Melting_Point 182-184° dec. Alfa-Aesar

Activity (Go SEA)

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