UCSF

ZINC20218590

Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2008 17 Yes

Other Names:

MFCD02185871

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) 1.89 3.45 -6.72 0 3 0 25 252.314 2

Vendor Notes

Note Type Comments Provided By
melting_point 93 - 95 KeyOrganics

Activity (Go SEA)

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