UCSF

ZINC36125095

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 23 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) 2.54 7.36 -41.96 2 5 1 40 319.473 5
Mid Mid (pH 6-8) 2.54 6.95 -42.81 2 5 1 40 319.473 5

Activity (Go SEA)

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