UCSF

ZINC36895564

Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2009 13 Yes

Other Names:

MFCD11180930

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) 0.37 2.96 -60.43 1 6 -1 95 195.183 2
Mid Mid (pH 6-8) 0.37 2.8 -103.18 0 6 -2 93 194.175 2

Vendor Notes

Note Type Comments Provided By
MP 299 - 301 Enamine Building Blocks
MP 299...301 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.