UCSF

ZINC35892944

Substance Information

In ZINC since Heavy atoms Benign functionality
October 14th, 2009 31 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) 5.11 13.57 -7.8 0 4 0 32 436.6 4
Mid Mid (pH 6-8) 5.11 15.81 -51.44 1 4 1 33 437.608 4

Activity (Go SEA)

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