UCSF

ZINC59110792

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 25th, 2011 35 Yes

Popular Name: N-[(3E)-3-[(5S)-1-cyclopentyl-5-isopentyl-2,4-dioxo-3-piperidylidene]-1,1-dioxo-4H-benzo[e][1,2,4]th N-[(3E)-3-[(5S)-1-cyclopentyl-5-…

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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) 2.47 4.95 -51.21 1 10 -1 144 523.657 7 ↓
Hi High (pH 8-9.5) 3.05 4.44 -216.41 0 10 -3 152 521.641 7 ↓
Mid Mid (pH 6-8) 3.05 4.74 -108.24 1 10 -2 150 522.649 7 ↓
Mid Mid (pH 6-8) 2.47 4.51 -48.02 1 10 -1 144 523.657 7 ↓
Mid Mid (pH 6-8) 2.47 4.55 -113.31 0 10 -2 146 522.649 7 ↓
Lo Low (pH 4.5-6) 2.47 4.91 -21.84 2 10 0 142 524.665 7 ↓

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