UCSF

ZINC15250077

Substance Information

In ZINC since Heavy atoms Benign functionality
July 22nd, 2008 28 No

Download: MOL2 SDF SMILES Flexibase

Annotations

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Vendors

    None

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) 2.63 9.04 -9.39 0 7 0 51 396.52 6
Mid Mid (pH 6-8) 2.63 11.27 -44.86 1 7 1 53 397.528 6

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