UCSF

ZINC08733556

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2007 24 No

Other Names:

MFCD00243379

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) 1.98 7.45 -20.68 0 6 0 75 412.261 5

Vendor Notes

Note Type Comments Provided By
melting_point 180 - 182 KeyOrganics

Activity (Go SEA)

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