UCSF

ZINC33825620

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2009 23 Yes

Popular Name: 4-Chloro-2,6-bis(4-methyl-1-piperazinyl)-5-(methylthio)pyrimidine hydrochloride; Bis-2,4-(N-methylpiperazino)-6-chloro-5-methylthio-pyrimidine hydrochloride; LS-134901; Pyrimidine, 4-chloro-2,6-bis(4-methyl-1-piperazinyl)-5-(methylthio)-, monohydrochlorid 4-Chloro-2,6-bis(4-methyl-1-pipe…

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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) 2.36 11.9 -88.45 2 6 2 41 358.943 3 ↓
Hi High (pH 8-9.5) 2.36 7.19 -4.46 0 6 0 39 356.927 3 ↓
Mid Mid (pH 6-8) 2.36 9.55 -39.94 1 6 1 40 357.935 3 ↓

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