UCSF

ZINC67563024

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 11th, 2011 28 Yes

Popular Name: 6-[[(3S)-1-(o-tolylmethyl)pyrrolidin-3-yl]methyl]-2,5-dioxo-1H-1,6-naphthyridine-3-carbonitrile 6-[[(3S)-1-(o-tolylmethyl)pyrrol…

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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) 1.79 10.24 -67.77 2 6 1 83 375.452 4 ↓
Mid Mid (pH 6-8) 2.70 8.25 -79.25 1 6 0 86 374.444 4 ↓

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

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