UCSF

ZINC08762873

Substance Information

In ZINC since Heavy atoms Benign functionality
July 26th, 2007 32 No

Other Names:

MFCD01314824

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) 7.22 14.32 -9.07 1 4 0 46 478.301 5
Ref Reference (pH 7) 7.22 14.2 -11.56 1 4 0 46 478.301 5

Vendor Notes

Note Type Comments Provided By
melting_point 201 - 203 KeyOrganics

Activity (Go SEA)

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