UCSF

ZINC35295857

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2009 32 No

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) 3.38 10.1 -78.01 1 7 0 83 438.524 10
Lo Low (pH 4.5-6) 3.38 9.35 -56.58 2 7 1 81 439.532 10

Activity (Go SEA)

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