UCSF

ZINC09708624

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 7th, 2007 21 Yes

Popular Name: butyl-trimethyl-BLAHdione butyl-trimethyl-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) 2.34 0.06 -10.44 0 7 0 74 290.323 3 ↓
Mid Mid (pH 6-8) 2.34 0.94 -32.64 1 7 1 75 291.331 3 ↓

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