UCSF

ZINC05739164

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2006 26 Yes

Other Names:

MFCD01871669

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 3.24 -2.41 -45.86 1 5 1 54 386.419 4

Vendor Notes

Note Type Comments Provided By
melting_point 131 - 133 KeyOrganics

Activity (Go SEA)

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