UCSF

ZINC01842582

Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2004 18 Yes

CAS Number: 958-09-8

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) -0.90 -1.99 -11.21 4 8 0 119 251.246 2

Activity (Go SEA)

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