In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 21 | Yes |
Popular Name: (1R)-N'-cyclopropyl-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N'-propyl-ethane-1,2-diamine (1R)-N'-cyclopropyl-1-(3,4-dihyd…
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) | 0.48 | 7.61 | -37.53 | 3 | 4 | 1 | 49 | 291.415 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.48 | 6.89 | -126.2 | 4 | 4 | 2 | 51 | 292.423 | 6 | ↓ |