UCSF

ZINC16730582

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 6th, 2008 33 No

Popular Name: (5S)-4-(4-allyloxybenzoyl)-3-hydroxy-5-(4-isopropylphenyl)-1-(3-methoxypropyl)-5H-pyrrol-2-one (5S)-4-(4-allyloxybenzoyl)-3-hyd…

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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) 4.85 11.11 -59.29 0 6 -1 79 448.539 11 ↓
Mid Mid (pH 6-8) 5.29 10.08 -27.07 1 6 0 76 449.547 10 ↓
Mid Mid (pH 6-8) 4.26 11.06 -20.32 0 6 0 73 449.547 11 ↓

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