UCSF

ZINC36163193

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 17 Yes

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Annotations

None

Vendors

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) 3.28 8.57 -47.1 0 3 -1 49 233.287 6
Lo Low (pH 4.5-6) 3.28 6.5 -5.29 1 3 0 47 234.295 6

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Rings

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