UCSF

ZINC54931196

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 9th, 2010 13 No

Popular Name: N-ethyl-7,8-dihydro-5H-thiopyrano[4,3-c]pyridazin-3-amine N-ethyl-7,8-dihydro-5H-thiopyran…

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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) 1.68 4.48 -27.8 2 3 1 39 196.299 2 ↓
Mid Mid (pH 6-8) 1.68 4.44 -28.05 2 3 1 39 196.299 2 ↓
Mid Mid (pH 6-8) 1.68 4.32 -7.18 1 3 0 38 195.291 2 ↓

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

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