UCSF

ZINC36214558

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 19 Yes

Download: MOL2 SDF SMILES Flexibase

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) 1.59 2.28 -35.4 0 6 -1 84 306.747 7
Mid Mid (pH 6-8) 1.59 2.12 -12.13 1 6 0 82 307.755 7

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Rings

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