UCSF

ZINC65508166

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2011 25 Yes

Popular Name: 2,7-dimethyl-N-[[(2S)-2-methyl-2,3-dihydrobenzofuran-5-yl]methyl]-5,6,8,9-tetrahydropyrimido[4,5-d]a 2,7-dimethyl-N-[[(2S)-2-methyl-2…

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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) 2.50 10.21 -96.79 3 5 2 53 340.471 3 ↓
Hi High (pH 8-9.5) 2.50 7.68 -7.51 1 5 0 50 338.455 3 ↓
Mid Mid (pH 6-8) 2.50 9.8 -44.18 2 5 1 51 339.463 3 ↓

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

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