UCSF

ZINC01765469

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 9 Yes

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) 2.73 -0.28 -1.59 1 1 0 20 130.231 4

Vendor Notes

Note Type Comments Provided By
Boiling_Point 170-172? Alfa-Aesar
Boiling_Point 170-172° Alfa-Aesar

Activity (Go SEA)

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