UCSF

ZINC00078890

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2005 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) 2.55 -3.64 -56.13 1 6 -1 99 327.341 4
Hi High (pH 8-9.5) 2.55 -3.06 -116.2 0 6 -2 101 326.333 4

Activity (Go SEA)

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