UCSF

ZINC04367325

Substance Information

In ZINC since Heavy atoms Benign functionality
November 23rd, 2005 30 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 1.74 -2.26 -20.47 0 7 0 64 412.534 4

Activity (Go SEA)

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