UCSF

ZINC49512193

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2010 34 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) 1.57 9.15 -54.26 3 8 1 86 462.574 6
Mid Mid (pH 6-8) 1.57 6.95 -12.92 2 8 0 85 461.566 6

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