UCSF

ZINC04416964

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 28th, 2005 16 No

Popular Name: N'-(4-chloro-2-nitro-phenyl)-N,N-dimethyl-ethane-1,2-diamine N'-(4-chloro-2-nitro-phenyl)-N,N…

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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) 2.39 6.84 -46.39 2 5 1 62 244.702 5 ↓
Hi High (pH 8-9.5) 2.39 4.38 -5.66 1 5 0 61 243.694 5 ↓

Activity (Go SEA)

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