UCSF

ZINC06857444

Substance Information

In ZINC since Heavy atoms Benign functionality
April 28th, 2006 15 Yes

Other Names:

MFCD07410706

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) 4.18 8.2 -31.68 2 1 1 17 226.409 5
Hi High (pH 8-9.5) 4.18 7.88 -1.23 1 1 0 12 225.401 5

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% )