UCSF

ZINC34321155

Substance Information

In ZINC since Heavy atoms Benign functionality
August 23rd, 2009 15 Yes

Other Names:

MFCD12169429

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) 0.10 2.52 -109.05 5 3 2 52 208.305 3
Mid Mid (pH 6-8) 0.10 0.02 -50.09 4 3 1 51 207.297 3
Mid Mid (pH 6-8) 0.10 2.18 -33.73 4 3 1 51 207.297 3

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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