UCSF

ZINC31560779

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2009 26 Yes

Popular Name: 1-(4-Acetoxy-4-phenyl-1,3,6-trimethyl-3-piperidinomethyl)morpholine, dihydrochloride; 4-Piperidinol, 5-morpholinomethyl-4-phenyl-1,2,5-trimethyl-, acetate, dihydrochloride; 5-Morpholinomethyl-4-phenyl-1,2,5-trimethyl-4-piperidinol-, acetate, dihydrochlori 1-(4-Acetoxy-4-phenyl-1,3,6-trim…

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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) 3.02 8.6 -41.11 1 5 1 43 361.506 5 ↓
Hi High (pH 8-9.5) 3.02 6.56 -6 0 5 0 42 360.498 5 ↓
Lo Low (pH 4.5-6) 3.02 10.23 -110.79 2 5 2 44 362.514 5 ↓

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