UCSF

ZINC72482012

Substance Information

In ZINC since Heavy atoms Benign functionality
July 13th, 2012 15 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) 4.39 4.48 -9.53 1 4 0 55 215.293 6

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Boiling_Point n.d. Squarix

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