UCSF

ZINC19852137

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2008 29 No

Other Names:

MFCD04150378

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) 2.91 6.94 -11.5 2 7 0 127 387.443 4
Lo Low (pH 4.5-6) 2.91 6.77 -53.4 3 7 1 129 388.451 4

Activity (Go SEA)

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