UCSF

ZINC01792817

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 20 Yes

Other Names:

F0897-0124

MFCD00141578

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) 3.78 1.06 -13.89 0 3 0 39 306.148 2

Vendor Notes

Note Type Comments Provided By
melting_point 189 - 191 KeyOrganics

Activity (Go SEA)

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