UCSF

ZINC31934892

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 23 No

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 1.84 7.28 -23.42 1 7 0 90 335.385 7
Hi High (pH 8-9.5) 2.02 6.2 -38.01 0 7 -1 97 334.377 7

Activity (Go SEA)

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