UCSF

ZINC20405860

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2008 19 Yes

Other Names:

MFCD03011978

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) 0.98 1.66 -8.84 1 5 0 66 262.309 5

Vendor Notes

Note Type Comments Provided By
melting_point 76 - 79 KeyOrganics

Activity (Go SEA)

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