| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2008 | 14 | No |
Popular Name: methyl 2-{[(E)-phenylmethylidene]amino}propanoate methyl 2-{[(E)-phenylmethylidene…
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CAS Number: 120328-90-7
| 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) | 1.97 | 5.51 | -8.89 | 0 | 3 | 0 | 39 | 191.23 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.97 | 6.3 | -36.47 | 1 | 3 | 1 | 40 | 192.238 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.97 | 5.76 | -34.58 | 1 | 3 | 1 | 40 | 192.238 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 0 | KeyOrganics |
