UCSF

ZINC19933886

Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 14 Yes

Other Names:

MFCD07838470

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) 0.91 2.98 -47.9 2 3 1 44 208.31 2
Hi High (pH 8-9.5) 0.91 1.58 -5.76 1 3 0 39 207.302 2

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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