In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 15 | Yes |
Popular Name: (2S)-N',2-dimethyl-N'-(3-pyrrolidin-1-ylpropyl)propane-1,3-diamine (2S)-N',2-dimethyl-N'-(3-pyrroli…
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) | 0.60 | 4.16 | -82.92 | 4 | 3 | 2 | 35 | 215.385 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.60 | 5.84 | -96.58 | 4 | 3 | 2 | 35 | 215.385 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.60 | 6.24 | -175.7 | 5 | 3 | 3 | 37 | 216.393 | 7 | ↓ |