UCSF

ZINC36643060

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2009 34 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) 5.59 15.97 -72.55 1 8 1 87 503.048 7
Hi High (pH 8-9.5) 5.59 13.51 -15.92 0 8 0 86 502.04 7

Activity (Go SEA)

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