UCSF

ZINC16319543

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 26th, 2008 33 No

Popular Name: (5S)-1-(3-diethylaminopropyl)-4-(2,4-dimethylthiazole-5-carbonyl)-3-hydroxy-5-(4-isopropylphenyl)-5H (5S)-1-(3-diethylaminopropyl)-4-…

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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) 4.05 12.5 -70.6 1 6 0 78 469.651 10 ↓
Mid Mid (pH 6-8) 4.49 11.35 -54.81 2 6 1 75 470.659 9 ↓
Mid Mid (pH 6-8) 3.47 12.39 -51.68 1 6 1 72 470.659 10 ↓

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