In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: (3R)-3-[4-[(2R)-3-amino-2-methyl-propyl]-1,4-diazepan-1-yl]azepan-2-one (3R)-3-[4-[(2R)-3-amino-2-methyl…
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) | 0.06 | 2.27 | -51.38 | 4 | 5 | 1 | 63 | 283.44 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.06 | 4.3 | -121.01 | 5 | 5 | 2 | 64 | 284.448 | 4 | ↓ |