UCSF

ZINC49391062

Substance Information

In ZINC since Heavy atoms Benign functionality
September 28th, 2010 16 No

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Annotations

Vendors

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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) 3.05 3.68 -42.24 0 2 -1 36 272.733 1
Lo Low (pH 4.5-6) 2.60 5.7 -8.53 1 2 0 33 273.741 1

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

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