UCSF

ZINC12359006

Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2008 8 Yes

CAS Number: 35794-11-7

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 1.37 3.63 -35.68 2 1 1 17 114.212 0

Vendor Notes

Note Type Comments Provided By
Boiling_Point 142-146? Alfa-Aesar
Boiling_Point 142-146° Alfa-Aesar

Activity (Go SEA)

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