UCSF

ZINC05027127

Substance Information

In ZINC since Heavy atoms Benign functionality
January 17th, 2006 26 Yes

Other Names:

MFCD03051180

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 3.22 -1.7 -48.37 2 6 1 55 356.446 6

Vendor Notes

Note Type Comments Provided By
melting_point 120 - 123 KeyOrganics

Activity (Go SEA)

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