UCSF

ZINC12023732

Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2008 31 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) 2.34 6.02 -59.77 2 8 1 97 466.967 7
Mid Mid (pH 6-8) 2.34 4.35 -24.56 1 8 0 96 465.959 7

Activity (Go SEA)

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