UCSF

ZINC05314696

Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2006 26 No

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Annotations

Vendors

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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) 3.43 5.05 -45.7 1 8 -1 132 393.162 4
Hi High (pH 8-9.5) 3.43 5.67 -117.5 0 8 -2 135 392.154 4
Mid Mid (pH 6-8) 3.43 -4.4 -10.79 2 8 0 129 394.17 4

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