In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2011 | 18 | Yes |
Popular Name: 3-[[4-[(3-hydroxypropylamino)methyl]phenyl]methylamino]propan-1-ol 3-[[4-[(3-hydroxypropylamino)met…
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) | 0.33 | 0.85 | -94.67 | 6 | 4 | 2 | 74 | 254.374 | 10 | ↓ |
Hi High (pH 8-9.5) | 0.33 | -0.51 | -43.92 | 5 | 4 | 1 | 69 | 253.366 | 10 | ↓ |