UCSF

ZINC36130650

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 26 Yes

Popular Name: 3-[(3,4-dioxo-2-pyrrolidin-1-yl-cyclobuten-1-yl)amino]-N-[2-(p-tolyl)ethyl]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) -1.18 2.62 -35.58 3 6 1 85 356.446 6 ↓
Hi High (pH 8-9.5) -1.18 3.42 -23.07 2 6 0 88 355.438 6 ↓
Mid Mid (pH 6-8) -1.18 3.69 -104.5 4 6 2 87 357.454 6 ↓

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

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