UCSF

ZINC23283049

Substance Information

In ZINC since Heavy atoms Benign functionality
December 28th, 2008 15 Yes

Other Names:

MFCD01467873

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) 2.81 6.66 -33.58 2 2 1 16 211.373 3
Mid Mid (pH 6-8) 2.81 5.52 -39.55 2 2 1 20 211.373 3
Mid Mid (pH 6-8) 2.81 7.81 -102.93 3 2 2 21 212.381 3

Vendor Notes

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

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