UCSF

ZINC41537931

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 19 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) 2.89 7.36 -45.3 1 4 -1 69 303.165 5
Lo Low (pH 4.5-6) 2.89 5.38 -7.23 2 4 0 66 304.173 5

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Rings

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