UCSF

ZINC05769170

Substance Information

In ZINC since Heavy atoms Benign functionality
February 13th, 2006 22 Yes

Other Names:

MFCD04125059

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) 2.00 -0.11 -51.59 1 4 -1 69 337.182 5

Vendor Notes

Note Type Comments Provided By
melting_point 189 - 191 KeyOrganics

Activity (Go SEA)

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