UCSF

ZINC05768935

Substance Information

In ZINC since Heavy atoms Benign functionality
February 13th, 2006 25 No

Other Names:

MFCD02571481

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) 2.76 1.54 -48.02 1 6 1 70 360.821 4

Vendor Notes

Note Type Comments Provided By
melting_point 122 - 124 KeyOrganics

Activity (Go SEA)

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