UCSF

ZINC41084646

Substance Information

In ZINC since Heavy atoms Benign functionality
April 16th, 2010 18 Yes

Other Names:

MFCD13344989

MFCD16622165

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) -0.45 3.67 -60.62 1 7 -1 112 245.218 3
Hi High (pH 8-9.5) 0.00 1.62 -133.22 0 7 -2 115 244.21 3

Vendor Notes

Note Type Comments Provided By
MP 194 - 196 Enamine Building Blocks
MP 194...196 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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