UCSF

ZINC40192706

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 36 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) 6.04 15.17 -16.73 1 6 0 65 485.628 11
Mid Mid (pH 6-8) 6.04 15.66 -41.09 2 6 1 67 486.636 11

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