UCSF

ZINC02241486

Substance Information

In ZINC since Heavy atoms Benign functionality
October 14th, 2004 35 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 5.14 8.23 -12.94 3 7 0 99 489.959 7
Mid Mid (pH 6-8) 5.14 9.03 -51.23 2 7 -1 102 488.951 7

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