UCSF

ZINC39915343

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 33 Yes

Popular Name: 2-[[(2R)-2-(4-chloro-3,5-dimethyl-phenoxy)propanoyl]amino]-N-(3-pyridylmethyl)-5,6-dihydro-4H-cyclop 2-[[(2R)-2-(4-chloro-3,5-dimethy…

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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) 4.32 10.58 -14.84 2 6 0 80 484.021 7 ↓
Hi High (pH 8-9.5) 4.50 8.74 -48.64 1 6 -1 87 483.013 7 ↓
Lo Low (pH 4.5-6) 4.32 11.05 -51.56 3 6 1 82 485.029 7 ↓

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