UCSF

ZINC19864193

Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2008 12 Yes

Other Names:

MFCD11135061

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) -0.79 0.22 -41.06 3 4 1 57 173.236 4
Hi High (pH 8-9.5) -0.79 -1.28 -8.27 2 4 0 53 172.228 4

Vendor Notes

Note Type Comments Provided By
MP 88 - 90 Enamine Building Blocks
MP 88...90 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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Analogs ( Draw Identity 99% 90% 80% 70% )