UCSF

ZINC13411046

Substance Information

In ZINC since Heavy atoms Benign functionality
June 18th, 2008 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) 1.49 6.91 -75.24 1 10 -1 154 344.259 5
Hi High (pH 8-9.5) 1.95 4.69 -143.32 0 10 -2 157 343.251 5

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

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