UCSF

ZINC16898735

Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2008 35 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) 6.19 12.43 -20.91 2 6 0 92 503.649 6
Hi High (pH 8-9.5) 6.65 11.09 -49.88 1 6 -1 95 502.641 6

Activity (Go SEA)

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