UCSF

ZINC36130642

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 24 Yes

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

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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) -2.24 1.42 -37.81 3 7 1 98 329.38 4 ↓
Hi High (pH 8-9.5) -2.24 2.21 -26.37 2 7 0 101 328.372 4 ↓
Mid Mid (pH 6-8) -2.24 2.49 -106.38 4 7 2 99 330.388 4 ↓

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

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