UCSF

ZINC05675839

Substance Information

In ZINC since Heavy atoms Benign functionality
February 9th, 2006 23 Yes

Other Names:

MFCD01316453

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) 5.32 1.1 -54.9 0 4 -1 57 366.611 3

Vendor Notes

Note Type Comments Provided By
melting_point 185 - 186 KeyOrganics

Activity (Go SEA)

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