UCSF

ZINC65538666

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 22 Yes

Popular Name: 4-[[4-(dimethylamino)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]methyl]-1-methyl-pyridin-2-one 4-[[4-(dimethylamino)-7,8-dihydr…

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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) 0.21 8.92 -55.73 1 6 1 55 300.386 3 ↓
Mid Mid (pH 6-8) 0.21 6.65 -15.04 0 6 0 54 299.378 3 ↓
Mid Mid (pH 6-8) 0.21 9.35 -115.61 2 6 2 57 301.394 3 ↓
Mid Mid (pH 6-8) 0.21 7.07 -40.97 1 6 1 56 300.386 3 ↓

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

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