UCSF

ZINC69919280

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2011 24 Yes

Popular Name: (3-amino-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-6-yl)-(1-tert-butyl-3,5-dimethyl-pyrazol-4-yl)methano (3-amino-7,8-dihydro-5H-pyrido[4…

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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) 0.81 5.36 -38.65 3 7 1 91 329.428 2 ↓
Mid Mid (pH 6-8) 0.81 5.24 -14.1 2 7 0 90 328.42 2 ↓
Mid Mid (pH 6-8) 0.81 5.41 -40.04 3 7 1 91 329.428 2 ↓

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Rings

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

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