UCSF

ZINC29131676

Substance Information

In ZINC since Heavy atoms Benign functionality
March 10th, 2009 15 No

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) 2.07 4.6 -23.96 1 4 0 68 204.181 1
Mid Mid (pH 6-8) 2.07 5.23 -43.28 0 4 -1 70 203.173 1

Vendor Notes

Note Type Comments Provided By
BP 425° Matrix Scientific
Warnings IRRITANT Matrix Scientific
Target Others Selleck Chemicals

Activity (Go SEA)

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