UCSF

ZINC35517334

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2009 29 No

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) 5.14 10.08 -52.43 1 6 -1 98 407.402 4
Mid Mid (pH 6-8) 5.60 8.15 -98.99 0 6 -2 102 406.394 4

Activity (Go SEA)

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