UCSF

ZINC31899623

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 32 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) 1.32 9.58 -63.43 2 9 1 103 475.62 6
Mid Mid (pH 6-8) 1.32 7.14 -30.34 1 9 0 102 474.612 6

Activity (Go SEA)

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