UCSF

ZINC12324335

Substance Information

In ZINC since Heavy atoms Benign functionality
April 14th, 2008 30 No

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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) 3.50 2.18 -55.2 1 5 1 57 403.433 3
Lo Low (pH 4.5-6) 3.50 2.29 -123.2 2 5 2 58 404.441 3

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