UCSF

ZINC08567140

Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2006 23 No

Other Names:

MFCD03030721

Download: MOL2 SDF SMILES Flexibase

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) 2.42 6.87 -16.71 2 5 0 67 326.377 3
Hi High (pH 8-9.5) 2.42 7.67 -41.03 1 5 -1 70 325.369 3

Activity (Go SEA)

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