UCSF

ZINC62035122

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 23rd, 2011 21 Yes

Popular Name: 2-[[3-methoxypropyl(methyl)amino]methyl]-N-propyl-thieno[2,3-d]pyrimidin-4-amine 2-[[3-methoxypropyl(methyl)amino…

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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) 2.32 7.12 -36.08 2 5 1 51 309.459 9 ↓
Mid Mid (pH 6-8) 2.32 4.78 -9.27 1 5 0 50 308.451 9 ↓

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

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