| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 29 | Yes |
Popular Name: 2-[[2-[(4-cyanophenyl)methyl-propyl-amino]acetyl]amino]-N-isopropyl-benzamide 2-[[2-[(4-cyanophenyl)methyl-pro…
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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) | 3.36 | 10.73 | -45.95 | 3 | 6 | 1 | 86 | 393.511 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.36 | 8.64 | -12.26 | 2 | 6 | 0 | 85 | 392.503 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
