UCSF

ZINC59817733

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 11th, 2011 33 No

Popular Name: 2-[(5-imino-6-methyl-3,4-diphenyl-5,6-dihydropyrimido[4,5-c]pyridazin-7-yl)sulfanyl]-1-(2-thienyl)ethanone 2-[(5-imino-6-methyl-3,4-dipheny…

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Other Names:

MFCD09758186

Download: MOL2 SDF SMILES Flexibase

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) 1.62 13.86 -34.5 2 6 1 86 470.603 6 ↓
Mid Mid (pH 6-8) 4.10 13.57 -12.84 1 6 0 85 469.595 6 ↓

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

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