UCSF

ZINC16736596

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 6th, 2008 32 No

Popular Name: (5S)-1-(3-dimethylaminopropyl)-5-(4-ethoxyphenyl)-3-hydroxy-4-[(E)-3-phenylprop-2-enoyl]-5H-pyrrol-2 (5S)-1-(3-dimethylaminopropyl)-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) 3.48 12.56 -77.36 1 6 0 74 434.536 10 ↓
Mid Mid (pH 6-8) 3.48 11.47 -57.14 2 6 1 71 435.544 9 ↓
Mid Mid (pH 6-8) 2.90 12.45 -59.69 1 6 1 68 435.544 10 ↓

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