UCSF

ZINC39389087

Substance Information

In ZINC since Heavy atoms Benign functionality
February 17th, 2010 33 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) 6.49 10.41 -10.07 2 4 0 58 492.485 6
Mid Mid (pH 6-8) 6.68 8.88 -42.76 1 4 -1 65 491.477 6

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