UCSF

ZINC71575955

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2011 27 Yes

Popular Name: 1-[2-(dimethylamino)-4-[methyl-[[2-(methylamino)pyrimidin-5-yl]methyl]amino]-6,8-dihydro-5H-pyrido[3 1-[2-(dimethylamino)-4-[methyl-[…

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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) 0.68 10.95 -40.97 2 9 1 92 371.469 5 ↓
Hi High (pH 8-9.5) 0.68 10.37 -18.74 1 9 0 90 370.461 5 ↓

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

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