UCSF

ZINC37825456

Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2009 20 No

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) 0.41 7.66 -167.54 4 5 3 46 305.512 9
Mid Mid (pH 6-8) 0.41 6.58 -96.56 3 5 2 41 304.504 9

Activity (Go SEA)

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