UCSF

ZINC78931551

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2012 16 Yes

Other Names:

MFCD27967420

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) -0.92 -3.24 -51.19 5 5 1 86 243.308 3
Mid Mid (pH 6-8) -0.92 -3.55 -8.71 4 5 0 85 242.3 3

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.