UCSF

ZINC39745248

Substance Information

In ZINC since Heavy atoms Benign functionality
March 6th, 2010 36 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) 4.27 11.95 -27.16 2 10 0 147 501.524 9
Hi High (pH 8-9.5) 4.33 9.59 -46.4 1 10 -1 153 500.516 9

Activity (Go SEA)

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