In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 18th, 2006 | 29 | No |
Popular Name: 1-(3-dimethylaminopropyl)-3-hydroxy-4-(3-methoxybenzoyl)-5-(4-pyridyl)-5H-pyrrol-2-one 1-(3-dimethylaminopropyl)-3-hydr…
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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) | 1.42 | 1.55 | -46.55 | 2 | 7 | 1 | 84 | 396.467 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.87 | 0.01 | -117.1 | 3 | 7 | 2 | 85 | 397.475 | 7 | ↓ |