UCSF

ZINC00120030

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 14 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) 2.05 -4.84 -12.36 1 3 0 46 205.238 0
Hi High (pH 8-9.5) 2.05 -4.28 -44.59 0 3 -1 48 204.23 0

Vendor Notes

Note Type Comments Provided By
MP 175 - 177 Enamine Building Blocks
MP 175...177 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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