UCSF

ZINC20132620

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2008 31 No

Popular Name: (5R)-1-(2-diethylaminoethyl)-4-(2,4-dimethylthiazole-5-carbonyl)-3-hydroxy-5-(3-methoxyphenyl)-5H-py (5R)-1-(2-diethylaminoethyl)-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) 2.30 9.03 -66.08 1 7 0 87 443.569 9 ↓
Hi High (pH 8-9.5) 2.30 6.82 -57.67 0 7 -1 86 442.561 9 ↓
Lo Low (pH 4.5-6) 2.30 8.22 -46.07 2 7 1 84 444.577 9 ↓

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