UCSF

ZINC20278795

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 23 Yes

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Annotations

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) 2.95 9.2 -49.93 1 5 -1 78 330.364 6
Lo Low (pH 4.5-6) 2.95 8.08 -12.74 2 5 0 75 331.372 6

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