UCSF

ZINC00991325

Substance Information

In ZINC since Heavy atoms Benign functionality
August 6th, 2004 26 Yes

Other Names:

MFCD01417131

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) 5.26 11.29 -19.12 1 4 0 55 357.438 4
Hi High (pH 8-9.5) 5.33 10.4 -49.7 0 4 -1 61 356.43 4

Activity (Go SEA)

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