UCSF

ZINC02566165

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 16 Yes

CAS Numbers: 525-21-3 , [525-21-3]

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) 1.54 3.45 -14.62 1 5 0 69 222.196 2

Vendor Notes

Note Type Comments Provided By
M.P 196-197 C Indofine
MP 196-197o C Indofine

Activity (Go SEA)

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