UCSF

ZINC03635084

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 26 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) 4.91 14.68 -47.12 1 3 1 31 352.498 8
Hi High (pH 8-9.5) 4.91 12.15 -7.75 0 3 0 30 351.49 8

Activity (Go SEA)

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