UCSF

ZINC31350269

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2009 32 Yes

Popular Name: 1,4-Cyclohexanebis(methylamine), N,N'-bis((2-trifluoromethyl)benzyl)-, dihydrochloride, (E)-; LS-56484; trans-N,N'-Bis((2-trifluoromethyl)benzyl)-1,4-cyclohexanebis(methylamine) dihydrochloride 1,4-Cyclohexanebis(methylamine),…

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Vendors

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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) 6.06 14.23 -106.85 4 2 2 33 460.506 10 ↓
Hi High (pH 8-9.5) 6.06 12.45 -6.37 2 2 0 24 458.49 10 ↓
Mid Mid (pH 6-8) 6.06 13.44 -44.28 3 2 1 29 459.498 10 ↓

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