UCSF

ZINC00386382

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2005 18 Yes

Other Names:

MFCD04153139

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) 4.27 9.12 -31.66 2 1 1 17 285.169 4
Hi High (pH 8-9.5) 4.27 7.76 -4.29 1 1 0 12 284.161 4

Activity (Go SEA)

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