UCSF

ZINC19470251

Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2008 12 Yes

Other Names:

MFCD09935262

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) -2.72 -0.82 -57.32 2 6 -1 104 193.204 2
Hi High (pH 8-9.5) -2.72 -0.33 -116.58 1 6 -2 101 192.196 2

Vendor Notes

Note Type Comments Provided By
MP 148 - 150 Enamine Building Blocks
MP 148...150 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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