UCSF

ZINC05735231

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2006 15 No

Other Names:

MFCD01936505

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) 2.92 2.26 -39.96 0 3 -1 49 235.593 3

Vendor Notes

Note Type Comments Provided By
melting_point 42 - 44 KeyOrganics

Activity (Go SEA)

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