UCSF

ZINC00024007

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 13 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) 3.18 -2.16 -6.1 2 2 0 38 302.14 1
Lo Low (pH 4.5-6) 3.18 -2.03 -26.45 3 2 1 40 303.148 1

Activity (Go SEA)

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