UCSF

ZINC53644240

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2010 26 Yes

Popular Name: 2-[[[(1R)-1-(4-fluorophenyl)-2,2-dimethyl-propyl]amino]methyl]-9-methyl-pyrido[1,2-a]pyrimidin-4-one 2-[[[(1R)-1-(4-fluorophenyl)-2,2…

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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) 4.70 11.32 -47.75 2 4 1 51 354.449 5 ↓
Mid Mid (pH 6-8) 4.70 10.65 -36.19 2 4 1 48 354.449 5 ↓
Mid Mid (pH 6-8) 4.70 10.33 -12.51 1 4 0 46 353.441 5 ↓

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