UCSF

ZINC44744027

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 22nd, 2010 24 Yes

Popular Name: (2S)-N-(1-ethylpropyl)-2-[4-[2-[[(1R)-1-methylpropyl]amino]-2-oxo-ethyl]piperazin-1-yl]propanamide (2S)-N-(1-ethylpropyl)-2-[4-[2-[…

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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) 2.23 5.32 -37.43 3 6 1 66 341.52 9 ↓
Mid Mid (pH 6-8) 2.23 3.12 -10.54 2 6 0 65 340.512 9 ↓
Mid Mid (pH 6-8) 2.23 5.31 -37.01 3 6 1 66 341.52 9 ↓

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