UCSF

ZINC20744987

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 28th, 2008 29 Yes

Popular Name: N-[2-(1,3-benzodioxol-5-ylmethyl)-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl]-2-methyl-propanam N-[2-(1,3-benzodioxol-5-ylmethyl…

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Vendors

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) 2.83 9.32 -64.94 2 7 1 70 393.467 4 ↓
Hi High (pH 8-9.5) 2.83 7.04 -19.44 1 7 0 69 392.459 4 ↓
Mid Mid (pH 6-8) 2.83 7.46 -39.02 2 7 1 70 393.467 4 ↓
Lo Low (pH 4.5-6) 2.83 9.69 -126.73 3 7 2 71 394.475 4 ↓

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