UCSF

ZINC31920920

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 24 No

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Annotations

Vendors

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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) 5.95 13.21 -12.27 0 2 0 17 332.834 3
Lo Low (pH 4.5-6) 5.95 13.63 -30.06 1 2 1 19 333.842 3

Activity (Go SEA)

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