UCSF

ZINC36638098

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2009 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) 6.28 13.06 -48.94 1 7 1 65 484.642 12
Hi High (pH 8-9.5) 6.28 11.09 -8.8 0 7 0 64 483.634 12

Activity (Go SEA)

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