UCSF

ZINC19973797

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2008 30 No

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

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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) 3.03 11.31 -72.58 1 6 0 78 414.477 9 ↓
Lo Low (pH 4.5-6) 3.03 10.49 -46.77 2 6 1 75 415.485 9 ↓

Activity (Go SEA)

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