UCSF

ZINC06682553

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 15th, 2006 27 Yes

Popular Name: [10-(4-ethylpiperazin-1-yl)-8-methyl-3,7,9-triazabicyclo[4.4.0]deca-7,9,11-trien-3-yl]-phenyl-methan [10-(4-ethylpiperazin-1-yl)-8-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) 1.39 10.56 -52.49 1 6 1 54 366.489 3 ↓
Mid Mid (pH 6-8) 1.39 10.96 -96.36 2 6 2 55 367.497 3 ↓
Mid Mid (pH 6-8) 1.39 8.33 -10.41 0 6 0 53 365.481 3 ↓

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