In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 18 | Yes |
Popular Name: (1S,2R)-N2-cyclopentyl-N2-methyl-1-(p-tolyl)propane-1,2-diamine (1S,2R)-N2-cyclopentyl-N2-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) | 1.64 | 7.7 | -29.07 | 3 | 2 | 1 | 30 | 247.406 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 7.97 | -113.14 | 4 | 2 | 2 | 32 | 248.414 | 4 | ↓ |