In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2009 | 18 | Yes |
Popular Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(1S)-1-methylpropyl]ethane-1,2-diamine N-(1,3-benzodioxol-5-ylmethyl)-N…
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) | 1.64 | 4.42 | -126.66 | 4 | 4 | 2 | 51 | 252.358 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 2.35 | -51.95 | 3 | 4 | 1 | 49 | 251.35 | 6 | ↓ |