In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: (3S,4S)-N3-[(1S)-1,2-dimethylpropyl]-N3-methyl-N4-propyl-chromane-3,4-diamine (3S,4S)-N3-[(1S)-1,2-dimethylpro…
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) | 3.90 | 7.45 | -34.49 | 2 | 3 | 1 | 29 | 291.459 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.90 | 9.11 | -115.75 | 3 | 3 | 2 | 30 | 292.467 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.90 | 8.25 | -31.26 | 2 | 3 | 1 | 26 | 291.459 | 6 | ↓ |