UCSF

ZINC03471216

Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2004 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) 1.31 2.19 -48.94 4 3 1 57 218.276 4
Hi High (pH 8-9.5) 1.31 1.81 -7.55 3 3 0 55 217.268 4

Vendor Notes

Note Type Comments Provided By
MP 105 - 107 Enamine Building Blocks
MP 105...107 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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