UCSF

ZINC04171702

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2005 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 -5.69 -55.56 2 5 1 49 325.502 5
Mid Mid (pH 6-8) 1.36 -4.2 -137.2 3 5 2 50 326.51 5

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

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