In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 21 | Yes |
Popular Name: (1S)-1-(4-isopropoxyphenyl)-N-methyl-N-(thiazol-4-ylmethyl)ethane-1,2-diamine (1S)-1-(4-isopropoxyphenyl)-N-me…
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) | 2.09 | 4.1 | -49.06 | 3 | 4 | 1 | 53 | 306.455 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.09 | 6.18 | -119.64 | 4 | 4 | 2 | 54 | 307.463 | 7 | ↓ |