UCSF

ZINC01014697

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2006 28 No

Other Names:

MFCD02955015

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) 5.28 -0.27 -11.91 0 4 0 47 385.492 5
Lo Low (pH 4.5-6) 5.28 0.13 -9.51 0 4 0 47 385.492 5

Activity (Go SEA)

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