UCSF

ZINC35632675

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2009 32 Yes

Popular Name: N-[(3S)-1-[2-(cyclopropylamino)-3,4-dioxo-cyclobuten-1-yl]-3-piperidyl]-5-methylsulfonyl-indoline-1- N-[(3S)-1-[2-(cyclopropylamino)-…

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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) -2.25 1.49 -48.88 3 9 1 122 459.548 3 ↓
Mid Mid (pH 6-8) -2.25 2.27 -31.87 2 9 0 125 458.54 3 ↓

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

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