UCSF

ZINC09707478

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 7th, 2007 31 No

Popular Name: (3-chlorophenyl)methyl-dimethyl-phenyl-BLAHdione (3-chlorophenyl)methyl-dimethyl-…

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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) 3.91 0.78 -10.24 0 8 0 77 434.887 3 ↓
Mid Mid (pH 6-8) 3.91 1.09 -36.75 1 8 1 78 435.895 3 ↓

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

No pre-computed analogs available. Try a structural similarity search.