UCSF

ZINC19230078

Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2008 17 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) 0.13 3.23 -91.17 3 5 2 55 252.343 2
Hi High (pH 8-9.5) 0.13 1.91 -10.66 1 5 0 50 250.327 2

Vendor Notes

Note Type Comments Provided By
MP 180 - 192 Enamine Building Blocks
MP 180...192 Enamine Building Blocks
MP 209 - 211 Enamine Building Blocks
MP 209...211 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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