UCSF

ZINC35298395

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2009 14 Yes

CAS Number: 934991-97-6

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 6.35 -40.77 2 2 1 20 191.298 1

Vendor Notes

Note Type Comments Provided By
Melting_Point 136-140? Alfa-Aesar
Melting_Point 136-140° Alfa-Aesar

Activity (Go SEA)

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