UCSF

ZINC66422498

Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2011 23 No

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Annotations

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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) 2.83 7.39 -46.62 2 5 1 54 359.277 7
Hi High (pH 8-9.5) 2.83 5.64 -10.6 1 5 0 53 358.269 7

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

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