UCSF

ZINC57984747

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2011 25 Yes

Popular Name: (2S)-2-(cyclohexylmethyl)-N-(5-methyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridin-2-yl)pyrrolidine-1-carbo (2S)-2-(cyclohexylmethyl)-N-(5-m…

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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) 4.20 8.25 -9.1 1 5 0 48 362.543 3 ↓
Mid Mid (pH 6-8) 4.20 10.97 -47.38 2 5 1 50 363.551 3 ↓

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

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