UCSF

ZINC14007613

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 1st, 2008 27 Yes

Popular Name: 2-[7-(1,3-benzodioxol-5-yl)-2-methyl-thiazolo[4,5-d]pyridazin-4-yl]sulfanyl-N,N-diethyl-ethanamine 2-[7-(1,3-benzodioxol-5-yl)-2-me…

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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) 3.74 8.62 -39.9 1 6 1 62 403.553 7 ↓
Hi High (pH 8-9.5) 3.74 6.51 -12.18 0 6 0 60 402.545 7 ↓

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

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