UCSF

ZINC33756417

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2009 17 Yes

Popular Name: 2,4(1H,3H)-Pyrimidinedione, 5-(aminomethyl)-1-cyclohexyl-3-methyl-, monohydrochloride; 5-(Aminomethyl)-1-cyclohexyl-3-methyl-uracil hydrochloride; LS-158550; Uracil, 5-(aminomethyl)-1-cyclohexyl-3-methyl-, monohydrochloride 2,4(1H,3H)-Pyrimidinedione, 5-(a…

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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) 0.48 4 -55.35 3 5 1 72 238.311 2 ↓
Hi High (pH 8-9.5) 0.48 3.59 -10.51 2 5 0 70 237.303 2 ↓

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