UCSF

ZINC20285780

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 12 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) -1.01 -0.36 -48.75 4 4 1 73 166.204 4
Mid Mid (pH 6-8) -1.01 -1.76 -12.79 3 4 0 68 165.196 4

Vendor Notes

Note Type Comments Provided By
MP 200 - 202 Enamine Building Blocks
MP 200...202 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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