UCSF

ZINC41718755

Substance Information

In ZINC since Heavy atoms Benign functionality
April 22nd, 2010 27 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) 0.41 5.13 -41.87 3 8 1 84 371.465 7
Hi High (pH 8-9.5) 0.41 2.84 -11.69 2 8 0 82 370.457 7
Mid Mid (pH 6-8) 0.41 5.1 -44.77 3 8 1 84 371.465 7

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