UCSF

ZINC21303127

Substance Information

In ZINC since Heavy atoms Benign functionality
December 3rd, 2008 17 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) 5.61 10.94 -3.41 0 0 0 0 242.387 3

Vendor Notes

Note Type Comments Provided By
BP 140 / 1.3 TCI
Purity 98%min APIChem

Activity (Go SEA)

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