UCSF

ZINC33765922

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2009 32 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) 6.70 12.66 -10.14 0 5 0 53 444.556 5
Ref Reference (pH 7) 6.70 13.95 -10.36 0 5 0 53 444.556 5
Lo Low (pH 4.5-6) 6.70 14.29 -27.2 1 5 1 54 445.564 5
Lo Low (pH 4.5-6) 6.70 13.14 -28.94 1 5 1 54 445.564 5

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