UCSF

ZINC69903161

Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2011 23 No

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Annotations

None

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) 3.37 8.24 -34.11 1 5 -1 74 331.417 5
Hi High (pH 8-9.5) 3.41 7.23 -109.33 0 5 -2 74 330.409 5
Mid Mid (pH 6-8) 2.83 9.85 -9.62 2 5 0 67 332.425 6

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

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