UCSF

ZINC19927955

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 28 No

Popular Name: (5R)-1-(3-dimethylaminopropyl)-4-(4-fluorobenzoyl)-3-hydroxy-5-(5-methyl-2-furyl)-5H-pyrrol-2-one (5R)-1-(3-dimethylaminopropyl)-4…

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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) 2.32 9.32 -76.89 1 6 0 78 386.423 7 ↓
Lo Low (pH 4.5-6) 2.32 8.5 -54.23 2 6 1 75 387.431 7 ↓

Activity (Go SEA)

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