In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 14 | Yes |
Popular Name: (3S)-N1,N1-dimethyl-N3-(thiazol-4-ylmethyl)butane-1,3-diamine (3S)-N1,N1-dimethyl-N3-(thiazol-…
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) | 1.30 | 3.7 | -34.26 | 2 | 3 | 1 | 29 | 214.358 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.30 | 4.91 | -98.61 | 3 | 3 | 2 | 34 | 215.366 | 6 | ↓ |