UCSF

ZINC36638104

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2009 35 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) 3.21 9.02 -52.18 1 9 1 93 519.669 9
Hi High (pH 8-9.5) 3.21 6.65 -14.2 0 9 0 92 518.661 9

Activity (Go SEA)

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