| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 20th, 2011 | 30 | Yes |
Popular Name: 4-[[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzoyl]amino]benzenesulfonic 4-[[4-(3,4-dihydro-1H-isoquinoli…
None
| 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) | 1.01 | 6.22 | -52.17 | 1 | 6 | -1 | 90 | 421.498 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.01 | 8.5 | -87.6 | 2 | 6 | 0 | 91 | 422.506 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
