UCSF

ZINC39500346

Substance Information

In ZINC since Heavy atoms Benign functionality
February 27th, 2010 27 No

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Annotations

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Vendors

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) 1.20 3.93 -13.96 1 8 0 88 365.393 7
Lo Low (pH 4.5-6) 1.20 4.4 -35.46 2 8 1 90 366.401 7

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

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