UCSF

ZINC60466350

Substance Information

In ZINC since Heavy atoms Benign functionality
March 26th, 2011 21 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 1.04 2.24 -41.12 4 6 1 86 292.359 6
Hi High (pH 8-9.5) 1.04 0.41 -19.41 3 6 0 85 291.351 6

Activity (Go SEA)

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