UCSF

ZINC38907759

Substance Information

In ZINC since Heavy atoms Benign functionality
January 31st, 2010 33 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) 5.23 13.48 -14.43 0 5 0 41 444.623 7
Mid Mid (pH 6-8) 5.23 15.5 -38.87 1 5 1 43 445.631 7
Lo Low (pH 4.5-6) 5.23 16.36 -129.73 2 5 2 44 446.639 7
Lo Low (pH 4.5-6) 5.23 15.67 -54.85 1 5 1 43 445.631 7

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