UCSF

ZINC21951677

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2008 16 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) 0.46 4.16 -55.12 2 3 1 37 227.234 1
Mid Mid (pH 6-8) 0.46 2.78 -10.22 1 3 0 32 226.226 1

Vendor Notes

Note Type Comments Provided By
MP 236 - 238 Enamine Building Blocks
MP 236...238 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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