UCSF

ZINC05594103

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 6th, 2006 21 No

Popular Name: 2-Amino-benzoic acid (2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazide 2-Amino-benzoic acid (2-oxo-1,2-…

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Other Names:

MFCD00573958

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) 1.77 2.84 -11.93 4 6 0 100 280.287 2 ↓
Ref Reference (pH 7) 1.77 2.65 -17.29 4 6 0 100 280.287 2 ↓
Hi High (pH 8-9.5) 2.23 1.09 -48.23 3 6 -1 103 279.279 2 ↓
Hi High (pH 8-9.5) 2.23 0.76 -58.02 3 6 -1 103 279.279 2 ↓

Activity (Go SEA)

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