UCSF

ZINC05133801

Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2006 11 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) 2.65 1.07 -28.84 1 1 1 4 154.277 1

Vendor Notes

Note Type Comments Provided By
MP 167-168° Matrix Scientific
BP 205-208°/745 Torr Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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