UCSF

ZINC04745391

Substance Information

In ZINC since Heavy atoms Benign functionality
January 2nd, 2006 18 No

Other Names:

MFCD00139083

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) 1.31 -3.83 -38.42 1 5 1 44 284.386 3

Vendor Notes

Note Type Comments Provided By
melting_point 148 - 150 KeyOrganics

Activity (Go SEA)

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