UCSF

ZINC10736264

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2007 30 Yes

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) 2.50 -5.01 -18.17 2 7 0 95 429.542 5
Hi High (pH 8-9.5) 2.50 -4.43 -49.16 1 7 -1 97 428.534 5

Activity (Go SEA)

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