UCSF

ZINC20171539

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2008 31 No

Popular Name: (5S)-1-(3-diethylaminopropyl)-3-hydroxy-5-(4-methoxyphenyl)-4-(5-methylfuran-2-carbonyl)-5H-pyrrol-2 (5S)-1-(3-diethylaminopropyl)-3-…

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Download: MOL2 SDF SMILES Flexibase

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) 2.97 9.76 -71.34 1 7 0 87 426.513 10 ↓
Lo Low (pH 4.5-6) 2.97 8.94 -45.45 2 7 1 84 427.521 10 ↓

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