UCSF

ZINC37506613

Substance Information

In ZINC since Heavy atoms Benign functionality
November 26th, 2009 19 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) -0.63 -1.99 -23.65 1 7 0 104 306.365 3
Hi High (pH 8-9.5) -0.18 -4.05 -56.12 0 7 -1 107 305.357 3

Activity (Go SEA)

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