UCSF

ZINC31845053

Substance Information

In ZINC since Heavy atoms Benign functionality
April 17th, 2009 23 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) 1.62 4.53 -14.77 1 6 0 72 331.759 4
Lo Low (pH 4.5-6) 1.62 4.98 -51.14 2 6 1 73 332.767 4

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