UCSF

ZINC08113110

Substance Information

In ZINC since Heavy atoms Benign functionality
July 1st, 2006 27 No

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) 3.00 8 -59.94 1 6 1 70 410.585 7
Mid Mid (pH 6-8) 3.00 5.41 -21.04 0 6 0 68 409.577 7

Activity (Go SEA)

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