UCSF

ZINC69092526

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 18th, 2011 22 Yes

Popular Name: 2-[[methyl(propyl)amino]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one 2-[[methyl(propyl)amino]methyl]-…

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Vendors

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) 3.45 9.68 -51.47 2 4 1 50 314.434 5 ↓
Hi High (pH 8-9.5) 3.91 7.05 -46.06 1 4 0 53 313.426 5 ↓
Mid Mid (pH 6-8) 3.45 7.37 -10.77 1 4 0 49 313.426 5 ↓

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

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