UCSF

ZINC22148355

Substance Information

In ZINC since Heavy atoms Benign functionality
December 13th, 2008 15 Yes

Other Names:

MFCD09050160

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) 1.88 1.65 -11.23 3 4 0 72 228.317 4
Hi High (pH 8-9.5) 1.88 1.69 -42.08 2 4 -1 74 227.309 4

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
MP 99 - 101 Enamine Building Blocks
MP 99...101 Enamine Building Blocks

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