UCSF

ZINC08441310

Substance Information

In ZINC since Heavy atoms Benign functionality
July 15th, 2006 38 No

Other Names:

MFCD03509143

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) 3.11 -0.15 -56.73 2 9 1 102 521.59 10
Mid Mid (pH 6-8) 2.53 -0.25 -66.08 1 9 1 99 521.59 10

Activity (Go SEA)

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