UCSF

ZINC36088634

Substance Information

In ZINC since Heavy atoms Benign functionality
October 22nd, 2009 22 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) 4.02 9.14 -42.36 2 3 1 34 337.896 7
Mid Mid (pH 6-8) 4.02 7.31 -9.79 1 3 0 32 336.888 7

Activity (Go SEA)

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