UCSF

ZINC32951462

Substance Information

In ZINC since Heavy atoms Benign functionality
May 14th, 2009 16 Yes

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) 2.34 3.71 -38.86 0 4 -1 62 228.256 1
Mid Mid (pH 6-8) 1.88 4.02 -22.71 1 4 0 59 229.264 1

Vendor Notes

Note Type Comments Provided By
MP 256 - 258 Enamine Building Blocks
MP 256...258 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.