UCSF

ZINC39237296

Substance Information

In ZINC since Heavy atoms Benign functionality
February 10th, 2010 14 Yes

Other Names:

MFCD28125213

MFCD28390225

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) 2.33 8.15 -48.44 0 2 -1 40 189.234 2
Lo Low (pH 4.5-6) 2.33 6.21 -5.87 1 2 0 37 190.242 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% )