UCSF

ZINC71491247

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2011 30 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) 2.59 8.24 -29.04 1 8 0 95 406.442 8
Mid Mid (pH 6-8) 2.59 8.67 -41.83 2 8 1 96 407.45 8

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

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