UCSF

ZINC34683270

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2009 36 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) 4.51 11.15 -59.93 2 7 1 73 491.608 8
Hi High (pH 8-9.5) 4.51 9.22 -15.77 1 7 0 71 490.6 8

Activity (Go SEA)

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