UCSF

ZINC23040652

Substance Information

In ZINC since Heavy atoms Benign functionality
December 24th, 2008 27 No

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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) 2.88 12.34 -18.07 1 5 0 58 381.501 5
Mid Mid (pH 6-8) 3.61 11.92 -44.73 0 5 -1 55 380.493 5

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

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