UCSF

ZINC11938473

Substance Information

In ZINC since Heavy atoms Benign functionality
March 17th, 2008 30 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) 4.00 1.25 -34.41 2 5 1 52 400.502 5
Lo Low (pH 4.5-6) 4.00 1.31 -108.21 3 5 2 53 401.51 5

Activity (Go SEA)

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