UCSF

ZINC09070718

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 7th, 2007 32 No

Popular Name: methyl 4-({2-(3-chlorophenyl)-1-[2-(dimethylamino)ethyl]-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-3-yl}carbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate methyl 4-({2-(3-chlorophenyl)-1-…

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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) 2.57 9.16 -68.55 2 8 0 107 459.93 8 ↓
Hi High (pH 8-9.5) 2.57 6.69 -54.97 1 8 -1 106 458.922 8 ↓
Mid Mid (pH 6-8) 3.02 10.19 -54.97 3 8 1 104 460.938 7 ↓

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