| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 20 | Yes |
Popular Name: 6-(2,3,4,5-tetrahydro-1,4-benzodiazepin-1-ylmethyl)-1,3,5-triazine-2,4-diamine 6-(2,3,4,5-tetrahydro-1,4-benzod…
| 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) | -0.11 | 6.1 | -37.08 | 6 | 7 | 1 | 111 | 272.336 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.11 | 4.84 | -7.67 | 5 | 7 | 0 | 106 | 271.328 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
