UCSF

ZINC58340288

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2011 18 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) 2.04 5.86 -52.27 1 3 1 39 268.402 4
Hi High (pH 8-9.5) 2.04 4.01 -11.89 0 3 0 37 267.394 4

Activity (Go SEA)

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