UCSF

ZINC40711825

Substance Information

In ZINC since Heavy atoms Benign functionality
April 11th, 2010 13 Yes

Other Names:

MFCD14600150

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) 2.55 6.32 -6.26 0 2 0 16 180.226 1
Lo Low (pH 4.5-6) 2.55 6.67 -25.32 1 2 1 17 181.234 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% )