UCSF

ZINC02963107

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2005 27 Yes

Popular Name: (4-chlorophenyl)-phenyl-BLAH (4-chlorophenyl)-phenyl-BLAH

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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) 6.80 0.35 -8.67 0 2 0 25 366.851 2 ↓
Lo Low (pH 4.5-6) 6.80 0.56 -86.68 2 2 2 28 368.867 2 ↓
Lo Low (pH 4.5-6) 6.80 0.47 -31.68 1 2 1 27 367.859 2 ↓

Activity (Go SEA)

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