UCSF

ZINC00740866

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 27 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) 4.47 11.17 -14.34 1 5 0 62 385.533 7
Hi High (pH 8-9.5) 4.28 9.63 -49.94 0 5 -1 69 384.525 7

Activity (Go SEA)

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