UCSF

ZINC00362336

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 14 Yes

Other Names:

MFCD02860306

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) 1.30 3.83 -8.23 1 3 0 42 192.262 4
Lo Low (pH 4.5-6) 1.30 4.11 -36.4 2 3 1 43 193.27 4

Activity (Go SEA)

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