In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2011 | 16 | Yes |
Popular Name: N2,N2-dimethyl-N1-[(3R)-1-methylpyrrolidin-3-yl]benzene-1,2-diamine N2,N2-dimethyl-N1-[(3R)-1-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) | 2.67 | 7.16 | -37 | 2 | 3 | 1 | 20 | 220.34 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.67 | 4.53 | -2.15 | 1 | 3 | 0 | 19 | 219.332 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.67 | 7.38 | -87.3 | 3 | 3 | 2 | 21 | 221.348 | 3 | ↓ |