UCSF

ZINC20162719

Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2008 25 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) 1.40 4.44 -11.23 0 6 0 55 359.451 4
Mid Mid (pH 6-8) 1.40 6.79 -39.48 1 6 1 56 360.459 4

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