UCSF

ZINC57925709

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2011 23 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) 3.23 6.44 -11.28 1 7 0 101 362.835 8
Hi High (pH 8-9.5) 3.23 6.2 -44.42 0 7 -1 103 361.827 8

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

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