| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 4th, 2010 | 10 | Yes |
Popular Name: 2-Propen-1-amine, 3-(3-pyridinyl)- (9CI) 2-Propen-1-amine, 3-(3-pyridinyl…
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CAS Number: 130025-03-5
| 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) | 0.05 | 1.81 | -46.04 | 3 | 2 | 1 | 41 | 135.19 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.05 | 1.41 | -4.68 | 2 | 2 | 0 | 39 | 134.182 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.05 | 2.28 | -93.39 | 4 | 2 | 2 | 42 | 136.198 | 2 | ↓ |
