UCSF

ZINC33787722

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2009 27 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) 2.43 9.34 -14.98 1 5 0 41 384.549 8
Mid Mid (pH 6-8) 2.43 11.61 -48.34 2 5 1 42 385.557 8
Lo Low (pH 4.5-6) 2.43 12.08 -111.41 3 5 2 43 386.565 8

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