UCSF

ZINC05358452

Substance Information

In ZINC since Heavy atoms Benign functionality
January 30th, 2006 16 No

Other Names:

MFCD00974739

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) 0.72 4.16 -109.27 0 5 -2 89 220.18 4

Vendor Notes

Note Type Comments Provided By
melting_point 132 - 134 KeyOrganics

Activity (Go SEA)

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