UCSF

ZINC22141195

Substance Information

In ZINC since Heavy atoms Benign functionality
December 13th, 2008 15 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) -0.30 1.08 -57.22 3 4 1 57 207.253 1
Mid Mid (pH 6-8) -0.30 -0.29 -14.48 2 4 0 53 206.245 1

Vendor Notes

Note Type Comments Provided By
MP 247 - 249 Enamine Building Blocks
MP 247...249 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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