UCSF

ZINC59817877

Substance Information

In ZINC since Heavy atoms Benign functionality
March 11th, 2011 29 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) -4.43 8.31 -72.9 7 10 1 176 406.463 9
Lo Low (pH 4.5-6) -4.43 8.59 -159.16 8 10 2 177 407.471 9

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

No pre-computed analogs available. Try a structural similarity search.