UCSF

ZINC38907556

Substance Information

In ZINC since Heavy atoms Benign functionality
January 31st, 2010 35 Yes

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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) 5.15 13.17 -14.21 0 5 0 41 468.645 5
Mid Mid (pH 6-8) 5.15 15.17 -39.74 1 5 1 43 469.653 5
Lo Low (pH 4.5-6) 5.15 16.04 -138.11 2 5 2 44 470.661 5
Lo Low (pH 4.5-6) 5.15 15.38 -57.68 1 5 1 43 469.653 5

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