UCSF

ZINC08885127

Substance Information

In ZINC since Heavy atoms Benign functionality
July 31st, 2007 17 Yes

Other Names:

MFCD08064777

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) 2.87 7.39 -8.94 0 3 0 51 225.295 1

Vendor Notes

Note Type Comments Provided By
melting_point 96 - 98 KeyOrganics

Activity (Go SEA)

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