| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 11th, 2009 | 16 | Yes |
Popular Name: (2S)-N2,2,4-trimethyl-N2-(3-thienylmethyl)pentane-1,2-diamine (2S)-N2,2,4-trimethyl-N2-(3-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) | 2.22 | 4.42 | -46.18 | 3 | 2 | 1 | 31 | 241.424 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.22 | 6.03 | -118.59 | 4 | 2 | 2 | 32 | 242.432 | 6 | ↓ |
