UCSF

ZINC00790747

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2005 25 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.00 8.82 -48.35 2 5 1 54 358.487 3
Hi High (pH 8-9.5) 2.00 6.47 -10.87 1 5 0 53 357.479 3

Activity (Go SEA)

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