UCSF

ZINC55033692

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2010 19 Yes

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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) 2.43 5.24 -39.1 3 3 1 46 266.405 8
Hi High (pH 8-9.5) 2.43 3.76 -4.31 2 3 0 41 265.397 8

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Rings

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