UCSF

ZINC69135211

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 19th, 2011 21 No

Popular Name: 5-[[(3S)-1,1-dioxothian-3-yl]amino]-2,3-dihydrophthalazine-1,4-dione 5-[[(3S)-1,1-dioxothian-3-yl]ami…

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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) 1.35 -2.71 -52.61 2 7 -1 115 308.339 2 ↓
Lo Low (pH 4.5-6) 1.35 -3.44 -16.99 3 7 0 112 309.347 2 ↓

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

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