UCSF

ZINC04489573

Substance Information

In ZINC since Heavy atoms Benign functionality
December 4th, 2005 18 Yes

Other Names:

MFCD03848678

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) 0.70 -3.25 -43.21 3 5 1 57 265.259 3

Vendor Notes

Note Type Comments Provided By
melting_point 82 - 84 KeyOrganics

Activity (Go SEA)

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