UCSF

ZINC36118567

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 30 Yes

Popular Name: 4-[[(3,4-dioxo-2-pyrrolidin-1-yl-cyclobuten-1-yl)amino]methyl]-N-phenethyl-benzamide 4-[[(3,4-dioxo-2-pyrrolidin-1-yl…

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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) -0.42 4.94 -38.32 3 6 1 85 404.49 6 ↓
Hi High (pH 8-9.5) -0.42 5.72 -24.1 2 6 0 88 403.482 6 ↓
Hi High (pH 8-9.5) 3.17 6.74 -15.1 2 6 0 82 403.482 7 ↓
Mid Mid (pH 6-8) -0.42 6.01 -112.56 4 6 2 87 405.498 6 ↓

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Rings

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

No pre-computed analogs available. Try a structural similarity search.