UCSF

ZINC09708609

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 7th, 2007 24 Yes

Popular Name: dimethyl-(o-tolylmethyl)BLAHdione dimethyl-(o-tolylmethyl)BLAHdione

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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) 2.68 0.78 -12.26 0 7 0 74 324.34 2 ↓
Mid Mid (pH 6-8) 2.68 1.69 -35.82 1 7 1 75 325.348 2 ↓

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