UCSF

ZINC09422111

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2007 28 No

Popular Name: 4-[(3-hydroxyphenyl)methylene]-2,2-dioxo-3-(3-pyridylmethyl)-2$l^{6}-thia-3-azabicyclo[4.4.0]deca-7, 4-[(3-hydroxyphenyl)methylene]-2…

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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) 2.71 -4.24 -14.71 1 6 0 87 392.436 3 ↓
Lo Low (pH 4.5-6) 2.71 -4.13 -41.15 2 6 1 88 393.444 3 ↓

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

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