UCSF

ZINC44203538

Substance Information

In ZINC since Heavy atoms Benign functionality
May 23rd, 2010 24 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) 2.83 8.93 -42 3 6 1 69 329.424 7
Mid Mid (pH 6-8) 2.83 8.42 -14.08 2 6 0 68 328.416 7

Activity (Go SEA)

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