UCSF

ZINC01387055

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 17 No

Other Names:

MFCD00118836

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) 1.58 5.22 -10.97 0 4 0 53 232.235 3

Vendor Notes

Note Type Comments Provided By
melting_point 80 - 82 KeyOrganics

Activity (Go SEA)

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