In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 19 | Yes |
Popular Name: 3-[4-[(3-fluorophenyl)methyl]-1,4-diazepan-1-yl]propan-1-amine 3-[4-[(3-fluorophenyl)methyl]-1,…
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) | 1.12 | 3.8 | -44.52 | 3 | 3 | 1 | 34 | 266.384 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.12 | 5.64 | -109.75 | 4 | 3 | 2 | 35 | 267.392 | 5 | ↓ |