UCSF

ZINC36175037

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 29 No

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) 5.04 9.7 -20.76 2 7 0 97 390.395 7
Hi High (pH 8-9.5) 5.04 10.71 -66.38 1 7 -1 100 389.387 7

Activity (Go SEA)

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