UCSF

ZINC36683122

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2009 26 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) 4.44 6.27 -22.3 1 8 0 114 393.186 4
Mid Mid (pH 6-8) 4.51 3.67 -49.8 0 8 -1 120 392.178 4

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