In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 16 | Yes |
Popular Name: (3S)-N1,N3-dimethyl-N1-(m-tolylmethyl)butane-1,3-diamine (3S)-N1,N3-dimethyl-N1-(m-tolylm…
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) | 2.55 | 5.96 | -37.3 | 2 | 2 | 1 | 20 | 221.368 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.55 | 7.01 | -36.81 | 2 | 2 | 1 | 16 | 221.368 | 6 | ↓ |