UCSF

ZINC31350262

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2009 28 Yes

Popular Name: 1,4-Cyclohexanebis(methylamine), N,N'-bis(3,4-dichlorobenzyl)-, dihydrochloride; Benzylamine, N,N'-(1,4-cyclohexylenedimethylene)bis(3,4-dichloro-, dihydrochloride; LS-56458; N,N'-(1,4-Cyclohexylenedimethylene)bis(3,4-dichlorobenzylamine) dihydrochloride 1,4-Cyclohexanebis(methylamine),…

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Annotations

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) 6.93 14.27 -113.33 4 2 2 33 462.292 8 ↓
Hi High (pH 8-9.5) 6.93 12.89 -51.92 3 2 1 29 461.284 8 ↓

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