UCSF

ZINC35844923

Substance Information

In ZINC since Heavy atoms Benign functionality
October 14th, 2009 35 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) 4.16 14.22 -15.04 0 6 0 70 473.617 14
Mid Mid (pH 6-8) 4.16 16.27 -53.17 1 6 1 71 474.625 14

Activity (Go SEA)

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