UCSF

ZINC49543811

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2010 24 No

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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) 1.11 4.62 -27.8 3 7 0 96 367.5 7
Mid Mid (pH 6-8) 1.29 3.39 -59.57 2 7 -1 102 366.492 7

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

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