UCSF

ZINC31554142

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2009 25 Yes

Popular Name: 4-(Dimethylamino)-2-(4-piperonyl-1-piperazinyl)pyridine; BRN 0766298; LS-135077; Pyrimidine, 4-(dimethylamino)-2-(4-piperonyl-1-piperazinyl)- 4-(Dimethylamino)-2-(4-piperonyl…

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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) 2.38 11.15 -100.59 2 7 2 56 343.431 4 ↓
Hi High (pH 8-9.5) 2.38 8.53 -10.95 0 7 0 54 341.415 4 ↓
Mid Mid (pH 6-8) 2.38 8.98 -33.44 1 7 1 55 342.423 4 ↓
Mid Mid (pH 6-8) 2.38 10.83 -47.2 1 7 1 55 342.423 4 ↓

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