UCSF

ZINC34679033

Substance Information

In ZINC since Heavy atoms Benign functionality
September 21st, 2009 26 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) 1.62 7.4 -19 1 6 0 72 347.353 4
Lo Low (pH 4.5-6) 1.62 7.86 -50.22 2 6 1 73 348.361 4

Activity (Go SEA)

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