UCSF

ZINC35784234

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2009 19 Yes

Popular Name: (1S,2R,4R)-4-tert-butyl-2-[(2R,5R)-2,5-dimethylmorpholin-4-yl]cyclohexanamine (1S,2R,4R)-4-tert-butyl-2-[(2R,5…

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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) 2.48 3.93 -1 2 3 0 38 268.445 2 ↓
Lo Low (pH 4.5-6) 2.48 5.76 -31.51 3 3 1 40 269.453 2 ↓
Lo Low (pH 4.5-6) 2.48 6.02 -123.23 4 3 2 41 270.461 2 ↓

Activity (Go SEA)

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