UCSF

ZINC04118233

Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2005 29 No

Other Names:

MFCD00169301

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) 6.02 3.37 -14.91 0 5 0 61 386.403 6

Vendor Notes

Note Type Comments Provided By
melting_point 159 - 160 KeyOrganics

Activity (Go SEA)

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