UCSF

ZINC76945681

Substance Information

In ZINC since Heavy atoms Benign functionality
September 12th, 2012 35 No

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) -0.93 5.94 -61.94 1 16 -1 246 547.529 13

Vendor Notes

Note Type Comments Provided By
Notes Photoreactive -Primary amine reactive Thiol cleavable -Water solubleRef: Lewis,R.V,et al(1977) Biochemistry 16, 5650-5654 Apollo Scientific Bioactives

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