UCSF

ZINC71790355

Substance Information

In ZINC since Heavy atoms Benign functionality
February 2nd, 2012 14 Yes

Other Names:

MFCD20232416

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) 0.46 1.76 -5.21 2 4 0 66 188.234 0
Mid Mid (pH 6-8) 0.46 4.17 -45.36 3 4 1 67 189.242 0

Vendor Notes

Note Type Comments Provided By
MP 215 - 217 Enamine Building Blocks
MP 215...217 Enamine Building Blocks
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.