UCSF

ZINC20262993

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 33 No

Popular Name: (5S)-1-(2-diethylaminoethyl)-4-(furan-2-carbonyl)-3-hydroxy-5-(3-methoxy-4-propoxy-phenyl)-5H-pyrrol (5S)-1-(2-diethylaminoethyl)-4-(…

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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) 2.94 10.67 -77.13 1 8 0 96 456.539 12 ↓
Hi High (pH 8-9.5) 2.94 8.35 -62.84 0 8 -1 95 455.531 12 ↓
Lo Low (pH 4.5-6) 2.94 9.71 -55.43 2 8 1 94 457.547 12 ↓

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