UCSF

ZINC26149441

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2009 35 Yes

Popular Name: 4-[(3,5-dimethylisoxazol-4-yl)methoxy]-3-methoxy-N-[2-[(2S)-4-methyl-2-phenyl-piperazin-1-yl]ethyl]b 4-[(3,5-dimethylisoxazol-4-yl)me…

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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) 2.73 10.12 -54.62 2 8 1 81 479.601 9 ↓
Mid Mid (pH 6-8) 2.73 12.09 -140.02 3 8 2 82 480.609 9 ↓
Mid Mid (pH 6-8) 2.73 7.65 -17.61 1 8 0 80 478.593 9 ↓

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