UCSF

ZINC49581029

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 32 Yes

Popular Name: N-(5-ethyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridin-2-yl)-1-(naphthalene-1-carbonyl)piperidine-4-carbox N-(5-ethyl-6,7-dihydro-4H-thiazo…

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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) 3.39 9.93 -22.7 1 6 0 66 448.592 4 ↓
Mid Mid (pH 6-8) 4.32 11.45 -56.4 2 6 1 70 449.6 3 ↓
Mid Mid (pH 6-8) 3.39 10.04 -38.97 2 6 1 67 449.6 4 ↓

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

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