| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 31st, 2009 | 38 | No |
Popular Name: Dimethyl 5-(2-(3-(4-aminophenyl)-3-oxopropanamido)-4-(methoxycarbonyl)phenoxy)isophthalate Dimethyl 5-(2-(3-(4-aminophenyl)…
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CAS Number: 116919-25-6
| 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) | 3.73 | 11.16 | -33.2 | 3 | 11 | 0 | 160 | 520.494 | 12 | ↓ |
| Hi High (pH 8-9.5) | 3.74 | 11.08 | -66.91 | 3 | 11 | -1 | 166 | 519.486 | 12 | ↓ |
