UCSF

ZINC21806357

Substance Information

In ZINC since Heavy atoms Benign functionality
December 9th, 2008 14 Yes

Other Names:

MFCD11124606

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) 4.40 8.04 -36.35 2 1 1 17 212.382 7
Hi High (pH 8-9.5) 4.40 6.73 -1.54 1 1 0 12 211.374 7

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% )