UCSF

ZINC20119891

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2008 32 No

Popular Name: (5R)-1-(2-diethylaminoethyl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(4-methylbenzoyl)-5H-pyrrol-2-one (5R)-1-(2-diethylaminoethyl)-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) 4.04 11.83 -74.07 1 6 0 74 436.552 10 ↓
Hi High (pH 8-9.5) 4.04 9.54 -58.81 0 6 -1 73 435.544 10 ↓
Lo Low (pH 4.5-6) 4.04 11.02 -53.14 2 6 1 71 437.56 10 ↓

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