UCSF

ZINC33813191

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 20th, 2009 37 No

Popular Name: (2R)-1-(2-diethylaminoethyl)-4-hydroxy-3-(4-methyl-2-phenyl-thiazole-5-carbonyl)-2-(4-nitrophenyl)-2 (2R)-1-(2-diethylaminoethyl)-4-h…

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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) 4.43 13.75 -69.15 1 9 0 124 520.611 10 ↓
Hi High (pH 8-9.5) 4.43 11.22 -54.53 0 9 -1 122 519.603 10 ↓
Lo Low (pH 4.5-6) 4.43 12.62 -55.28 2 9 1 121 521.619 10 ↓

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