UCSF

ZINC05948249

Substance Information

In ZINC since Heavy atoms Benign functionality
February 19th, 2006 26 No

Other Names:

MFCD02083103

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) 6.26 12.09 -9.74 0 3 0 34 381.262 3
Ref Reference (pH 7) 6.26 11.8 -11.19 0 3 0 34 381.262 3

Vendor Notes

Note Type Comments Provided By
melting_point 240 - 243 KeyOrganics

Activity (Go SEA)

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