UCSF

ZINC34234780

Substance Information

In ZINC since Heavy atoms Benign functionality
August 13th, 2009 31 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) 3.27 4.8 -47.98 1 7 -1 104 413.409 5
Hi High (pH 8-9.5) 3.27 5.57 -98.68 0 7 -2 107 412.401 5
Mid Mid (pH 6-8) 2.81 7.46 -12.4 2 7 0 101 414.417 5

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