UCSF

ZINC54931221

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 9th, 2010 17 Yes

Popular Name: N,6-dipropyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-3-amine N,6-dipropyl-7,8-dihydro-5H-pyri…

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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) 2.37 6.59 -44.64 2 4 1 42 235.355 5 ↓
Hi High (pH 8-9.5) 2.37 4.32 -6.83 1 4 0 41 234.347 5 ↓
Lo Low (pH 4.5-6) 2.37 6.71 -98.01 3 4 2 43 236.363 5 ↓

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

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