UCSF

ZINC15920190

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2008 27 No

Download: MOL2 SDF SMILES Flexibase

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) 1.29 2.63 -16.69 2 7 0 96 389.429 7
Mid Mid (pH 6-8) 0.71 3.42 -23.26 1 7 0 93 389.429 7

Activity (Go SEA)

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