UCSF

ZINC19944019

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 14 Yes

Popular Name: 3-amino-1-propyl-1,3-dihydro-2H-indol-2-one 3-amino-1-propyl-1,3-dihydro-2H-…

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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) -0.46 3.52 -7.38 2 3 0 46 190.246 2 ↓
Ref Reference (pH 7) -0.46 3.52 -5.76 2 3 0 46 190.246 2 ↓
Mid Mid (pH 6-8) -0.46 3.84 -43.62 3 3 1 48 191.254 2 ↓
Mid Mid (pH 6-8) -0.46 3.83 -43.44 3 3 1 48 191.254 2 ↓

Activity (Go SEA)

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