UCSF

ZINC36486963

Substance Information

In ZINC since Heavy atoms Benign functionality
November 5th, 2009 25 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) -5.03 -4.04 -108.7 12 12 1 235 360.395 12
Hi High (pH 8-9.5) -5.03 -4.28 -69.29 11 12 0 233 359.387 12

Activity (Go SEA)

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