UCSF

ZINC05878931

Substance Information

In ZINC since Heavy atoms Benign functionality
February 18th, 2006 20 No

Other Names:

MFCD03305816

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) 2.29 0.98 -10.98 0 4 0 42 290.388 5

Vendor Notes

Note Type Comments Provided By
melting_point 72 - 74 KeyOrganics

Activity (Go SEA)

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