UCSF

ZINC57924800

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2011 18 Yes

Other Names:

MFCD27959436

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) 3.44 8.33 -4.61 1 2 0 15 238.334 2
Mid Mid (pH 6-8) 3.44 7.57 -31.41 2 2 1 16 239.342 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% )

No pre-computed analogs available. Try a structural similarity search.