UCSF

ZINC05670429

Substance Information

In ZINC since Heavy atoms Benign functionality
February 9th, 2006 20 Yes

Other Names:

MFCD01315517

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) 4.58 3.19 -6.79 0 1 0 17 292.712 3

Vendor Notes

Note Type Comments Provided By
melting_point 38 - 40 KeyOrganics

Activity (Go SEA)

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