UCSF

ZINC12336277

Substance Information

In ZINC since Heavy atoms Benign functionality
April 14th, 2008 17 Yes

Other Names:

MFCD00202702

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) -1.54 -7.77 -50.78 1 6 -1 98 276.315 3

Vendor Notes

Note Type Comments Provided By
melting_point 204 - 206 KeyOrganics

Activity (Go SEA)

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