UCSF

ZINC36107012

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 20 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) 1.04 2.78 -7.34 1 6 0 56 284.404 4
Mid Mid (pH 6-8) 1.04 5.56 -47.28 2 6 1 57 285.412 4

Activity (Go SEA)

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