UCSF

ZINC69971951

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2011 23 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) 1.54 7.74 -14.04 1 7 0 99 315.329 5
Mid Mid (pH 6-8) 2.44 5.63 -39.89 0 7 -1 102 314.321 5

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

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