UCSF

ZINC36132915

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 26 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) 2.19 7.02 -10.17 0 5 0 42 358.413 4
Mid Mid (pH 6-8) 2.19 9.02 -50.67 1 5 1 43 359.421 4

Activity (Go SEA)

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