UCSF

ZINC19582819

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 4th, 2008 26 No

Popular Name: (5R)-1-(2-dimethylaminoethyl)-5-(2-fluorophenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-5H-pyrrol-2-one (5R)-1-(2-dimethylaminoethyl)-5-…

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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) 2.42 9.26 -70.83 1 5 0 65 374.437 6 ↓
Hi High (pH 8-9.5) 2.42 6.72 -57.18 0 5 -1 64 373.429 6 ↓
Lo Low (pH 4.5-6) 2.42 8.44 -49.98 2 5 1 62 375.445 6 ↓

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