UCSF

ZINC18182092

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2008 31 No

Popular Name: 3-hydroxy-4-(4-methoxy-3-methylbenzoyl)-5-(4-pyridinyl)-1-(3-pyridinylmethyl)-1,5-dihydro-2H-pyrrol-2-one 3-hydroxy-4-(4-methoxy-3-methylb…

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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) 1.68 7.97 -56.75 0 7 -1 95 414.441 6 ↓
Lo Low (pH 4.5-6) 1.68 7.15 -16 1 7 0 93 415.449 6 ↓

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