In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 24th, 2011 | 20 | Yes |
Popular Name: (2S)-N,N'-diethyl-2-methyl-N'-(1-naphthyl)propane-1,3-diamine (2S)-N,N'-diethyl-2-methyl-N'-(1…
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) | 4.13 | 10.98 | -38.82 | 2 | 2 | 1 | 20 | 271.428 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.13 | 10.7 | -94.46 | 3 | 2 | 2 | 21 | 272.436 | 7 | ↓ |