UCSF

ZINC14162776

Substance Information

In ZINC since Heavy atoms Benign functionality
July 4th, 2008 33 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) 2.12 9.42 -55.88 2 8 1 83 471.603 8
Hi High (pH 8-9.5) 2.12 7.2 -16.51 1 8 0 82 470.595 8
Mid Mid (pH 6-8) 2.12 9.59 -51.89 2 8 1 83 471.603 8

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