UCSF

ZINC26270371

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2009 31 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) 4.41 12.22 -31.07 1 9 0 123 441.465 8
Hi High (pH 8-9.5) 4.59 11.16 -52.84 0 9 -1 130 440.457 8

Activity (Go SEA)

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