UCSF

ZINC12025365

Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2008 33 Yes

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) 3.67 8.1 -59 2 7 1 88 497.012 8
Hi High (pH 8-9.5) 3.67 6.34 -20.97 1 7 0 87 496.004 8

Activity (Go SEA)

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