In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 20 | Yes |
Popular Name: (2S)-N1-[(R)-cyclopropyl(p-tolyl)methyl]-N2,N2,3-trimethyl-butane-1,2-diamine (2S)-N1-[(R)-cyclopropyl(p-tolyl…
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) | 4.14 | 8.65 | -34.36 | 2 | 2 | 1 | 20 | 275.46 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.14 | 11.22 | -31.22 | 2 | 2 | 1 | 16 | 275.46 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.14 | 11.19 | -108.7 | 3 | 2 | 2 | 21 | 276.468 | 7 | ↓ |