UCSF

ZINC04416790

Substance Information

In ZINC since Heavy atoms Benign functionality
November 28th, 2005 30 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) -1.21 11.12 -381.96 0 11 -5 218 425.366 13
Lo Low (pH 4.5-6) -1.21 9.16 -267.97 1 11 -4 215 426.374 13

Activity (Go SEA)

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