In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2011 | 18 | Yes |
Popular Name: (1R)-N-methyl-1-(3-methyl-2-thienyl)-N-(2-pyrrolidin-1-ylethyl)ethane-1,2-diamine (1R)-N-methyl-1-(3-methyl-2-thie…
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) | 1.44 | 5 | -104.67 | 4 | 3 | 2 | 35 | 269.458 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.44 | 4.27 | -30.32 | 3 | 3 | 1 | 34 | 268.45 | 6 | ↓ |