UCSF

ZINC20265800

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 22 No

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Annotations

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Vendors

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) 1.36 3.79 -100.61 1 6 0 82 324.402 3
Mid Mid (pH 6-8) 1.36 1.57 -60.9 0 6 -1 81 323.394 3

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

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