UCSF

ZINC41203272

Substance Information

In ZINC since Heavy atoms Benign functionality
April 17th, 2010 11 No

Other Names:

MFCD16302499

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) 1.97 5.04 -37.04 2 1 1 17 186.325 1
Mid Mid (pH 6-8) 1.97 3.83 -2.74 1 1 0 12 185.317 1

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% )