UCSF

ZINC62313348

Substance Information

In ZINC since Heavy atoms Benign functionality
April 29th, 2011 18 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) 0.30 -0.19 -49.76 1 6 -1 87 271.318 6
Lo Low (pH 4.5-6) 0.30 -0.21 -14.04 2 6 0 85 272.326 6

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Rings

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