UCSF

ZINC37833662

Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2009 15 No

Other Names:

MFCD12810645

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) 1.10 5.63 -11.81 0 3 0 33 226.707 4
Lo Low (pH 4.5-6) 1.10 6.1 -33.24 1 3 1 34 227.715 4

Activity (Go SEA)

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