UCSF

ZINC60219671

Substance Information

In ZINC since Heavy atoms Benign functionality
March 17th, 2011 11 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) 2.00 2.37 -28.56 1 3 -1 42 182.253 0
Lo Low (pH 4.5-6) 2.00 2.4 -10.08 2 3 0 43 183.261 0

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

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