UCSF

ZINC20389366

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2008 24 Yes

Other Names:

MFCD00244159

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) 5.41 10.45 -7.9 2 3 0 63 374.658 2

Vendor Notes

Note Type Comments Provided By
melting_point 233 - 235 KeyOrganics

Activity (Go SEA)

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