UCSF

ZINC43411555

Substance Information

In ZINC since Heavy atoms Benign functionality
May 13th, 2010 14 Yes

Other Names:

MFCD16070730

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) 1.19 1.07 -32.41 3 3 1 40 201.334 4
Mid Mid (pH 6-8) 1.19 2.23 -33.16 3 3 1 37 201.334 4
Lo Low (pH 4.5-6) 1.19 3.25 -106.83 4 3 2 41 202.342 4

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% )