UCSF

ZINC49320291

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2010 20 Yes

Popular Name: 4,5-dichloro-2-[[methyl-[(1S)-1-(5-methyl-2-thienyl)ethyl]amino]methyl]pyridazin-3-one 4,5-dichloro-2-[[methyl-[(1S)-1-…

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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) 3.45 6.29 -7.51 0 4 0 38 332.256 4 ↓
Mid Mid (pH 6-8) 3.45 8.78 -35.5 1 4 1 39 333.264 4 ↓

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

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