UCSF

ZINC08809470

Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2007 32 No

Other Names:

MFCD00169305

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) 5.78 5.23 -17.23 0 6 0 71 432.472 9

Vendor Notes

Note Type Comments Provided By
melting_point 131 - 133 KeyOrganics

Activity (Go SEA)

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