UCSF

ZINC38609938

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 38 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) 4.58 10.23 -15.78 2 8 0 101 512.61 10
Mid Mid (pH 6-8) 4.58 10.99 -55.25 1 8 -1 103 511.602 10

Activity (Go SEA)

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