In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 19 | Yes |
Popular Name: (2R)-2-[3-aminopropyl(cyclopropyl)amino]-1-(azepan-1-yl)propan-1-one (2R)-2-[3-aminopropyl(cyclopropy…
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) | 0.88 | 4.22 | -54.03 | 3 | 4 | 1 | 51 | 268.425 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.88 | 5.91 | -32.08 | 3 | 4 | 1 | 51 | 268.425 | 6 | ↓ |