UCSF

ZINC67332018

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 8th, 2011 28 Yes

Popular Name: N-[[(2S)-1-(cyclohexylmethyl)pyrrolidin-2-yl]methyl]-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-6-carboxam N-[[(2S)-1-(cyclohexylmethyl)pyr…

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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) 2.07 3.99 -65.79 3 8 0 115 385.468 5 ↓
Lo Low (pH 4.5-6) 1.61 5.92 -52.67 4 8 1 112 386.476 5 ↓

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

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