UCSF

ZINC66666485

Substance Information

In ZINC since Heavy atoms Benign functionality
August 29th, 2011 18 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) 0.14 2.51 -10.73 1 5 0 53 253.346 4
Mid Mid (pH 6-8) 0.14 4.24 -42.14 2 5 1 54 254.354 4

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

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