In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 19 | Yes |
Popular Name: (3S,4S)-N3-[(1S)-2-methoxy-1-methyl-ethyl]-N3,N4-dimethyl-chromane-3,4-diamine (3S,4S)-N3-[(1S)-2-methoxy-1-met…
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) | 1.88 | 4.12 | -37.54 | 2 | 4 | 1 | 38 | 265.377 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.88 | 3.24 | -3.56 | 1 | 4 | 0 | 34 | 264.369 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.88 | 5.89 | -111.85 | 3 | 4 | 2 | 40 | 266.385 | 5 | ↓ |