UCSF

ZINC13522957

Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2008 35 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) -4.85 3.58 -194.07 12 13 2 231 498.629 13
Hi High (pH 8-9.5) -4.85 3.25 -132.64 11 13 1 230 497.621 13

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