UCSF

ZINC02530736

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 15 Yes

CAS Number: 5826-73-3

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) 2.03 3.21 -6.72 0 4 0 52 210.229 4

Vendor Notes

Note Type Comments Provided By
Boiling_Point 150-152?/20mm Alfa-Aesar
Boiling_Point 150-152°/20mm Alfa-Aesar

Activity (Go SEA)

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