UCSF

ZINC10515546

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2007 27 Yes

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) 4.03 -3.18 -12.33 1 5 0 66 386.517 5
Hi High (pH 8-9.5) 4.03 -2.6 -42.21 0 5 -1 68 385.509 5

Activity (Go SEA)

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