UCSF

ZINC04950385

Substance Information

In ZINC since Heavy atoms Benign functionality
January 12th, 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) 3.70 8.99 -22.77 2 7 0 100 368.418 6
Lo Low (pH 4.5-6) 3.70 9.36 -36.29 3 7 1 101 369.426 6

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