UCSF

ZINC56634930

Substance Information

In ZINC since Heavy atoms Benign functionality
January 5th, 2011 12 No

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Annotations

Vendors

    None

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) -3.25 -8.86 -17.8 6 7 0 130 181.144 4
Hi High (pH 8-9.5) -3.25 -7.64 -56.01 5 7 -1 133 180.136 4
Hi High (pH 8-9.5) -3.06 -10.02 -47.1 5 7 -1 137 180.136 4

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