UCSF

ZINC19687507

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2008 14 Yes

Other Names:

MFCD04116778

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) -0.52 1.07 -47.08 3 4 1 51 200.306 3
Hi High (pH 8-9.5) -0.52 0.67 -8.06 2 4 0 50 199.298 3

Activity (Go SEA)

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