UCSF

ZINC09242098

Substance Information

In ZINC since Heavy atoms Benign functionality
August 15th, 2007 34 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) 6.18 0.19 -21.24 0 6 0 64 475.614 11
Lo Low (pH 4.5-6) 6.18 0.3 -57.1 1 6 1 65 476.622 11

Activity (Go SEA)

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