UCSF

ZINC08733557

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2007 27 No

Other Names:

MFCD00243382

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) 2.06 2.43 -25.57 0 6 0 74 401.362 6

Vendor Notes

Note Type Comments Provided By
melting_point 180 - 182 KeyOrganics

Activity (Go SEA)

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