UCSF

ZINC48263731

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 13th, 2010 30 Yes

Popular Name: N-[(1S)-1-(2,5-dimethoxyphenyl)ethyl]-2-[(2S)-2-[[(2S,6S)-2,6-dimethylmorpholin-4-yl]methyl]pyrrolid N-[(1S)-1-(2,5-dimethoxyphenyl)e…

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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) 2.94 7.06 -38.33 2 7 1 64 420.574 8 ↓
Lo Low (pH 4.5-6) 2.94 8.61 -116.79 3 7 2 66 421.582 8 ↓

Activity (Go SEA)

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